Pyrroles

Description:

Compounds containing a pyrrole ring, which is a five-member aromatic heterocycle with one nitrogen atom and four carbon atoms.

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Pyrroles

3-Methyl-3-(1H-pyrrol-1-yl)butanoic acid
- ≥95%
Cas Number: 395090-68-3 Compound CID: 2761125

Formula: C₉H₁₃NO₂ Molecular Weight: 167.21

IUPAC Name: 3-methyl-3-pyrrol-1-ylbutanoic acid

SMILES: CC(C)(CC(=O)O)N1C=CC=C1

InChIKey: FVUKITSPMXBMLI-UHFFFAOYSA-N

InChI: InChI=1S/C9H13NO2/c1-9(2,7-8(11)12)10-5-3-4-6-10/h3-6H,7H2,1-2H3,(H,11,12)
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3-Phenyl-1H-indole
- ≥97%
Cas Number: 1504-16-1 Compound CID: 96502

Formula: C₁₄H₁₁N Molecular Weight: 193.24

IUPAC Name: 3-phenyl-1H-indole

SMILES: C1=CC=C(C=C1)C2=CNC3=CC=CC=C32

InChIKey: XZNGTBLWFCRXKR-UHFFFAOYSA-N

InChI: InChI=1S/C14H11N/c1-2-6-11(7-3-1)13-10-15-14-9-5-4-8-12(13)14/h1-10,15H
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3-(1H-Pyrrol-1-yl)benzoic acid
- ≥98%
Cas Number: 61471-45-2 Compound CID: 736537

Formula: C₁₁H₉NO₂ Molecular Weight: 187.2

IUPAC Name: 3-pyrrol-1-ylbenzoic acid

SMILES: C1=CN(C=C1)C2=CC=CC(=C2)C(=O)O

InChIKey: PODFNQCZFHLJPH-UHFFFAOYSA-N

InChI: InChI=1S/C11H9NO2/c13-11(14)9-4-3-5-10(8-9)12-6-1-2-7-12/h1-8H,(H,13,14)
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2，5-DIMETHYL-1-(4-NITROPHENYL)-1H-PYRROLE
- ≥98%
Cas Number: 5044-22-4 Compound CID: 459085

Formula: C₁₂H₁₂N₂O₂ Molecular Weight: 216.24

IUPAC Name: 2,5-dimethyl-1-(4-nitrophenyl)pyrrole

SMILES: CC1=CC=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C

InChIKey: JXJRCFOGAIXRCU-UHFFFAOYSA-N

InChI: InChI=1S/C12H12N2O2/c1-9-3-4-10(2)13(9)11-5-7-12(8-6-11)14(15)16/h3-8H,1-2H3
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2-amino-1-benzyl-4，5-dimethyl-1H-pyrrole-3-carbonitrile
- ≥95%
Cas Number: 55817-72-6 Compound CID: 2763308

Formula: C₁₄H₁₅N₃ Molecular Weight: 225.3

IUPAC Name: 2-amino-1-benzyl-4,5-dimethylpyrrole-3-carbonitrile

SMILES: CC1=C(N(C(=C1C#N)N)CC2=CC=CC=C2)C

InChIKey: RJDOFGRDZKVLTM-UHFFFAOYSA-N

InChI: InChI=1S/C14H15N3/c1-10-11(2)17(14(16)13(10)8-15)9-12-6-4-3-5-7-12/h3-7H,9,16H2,1-2H3
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2-Amino-1-benzyl-4，5-diphenyl-1H-pyrrole-3-carbonitrile
- ≥95%
Cas Number: 55817-67-9 Compound CID: 2764501

Formula: C₂₄H₁₉N₃ Molecular Weight: 349.44

IUPAC Name: 2-amino-1-benzyl-4,5-diphenylpyrrole-3-carbonitrile

SMILES: C1=CC=C(C=C1)CN2C(=C(C(=C2N)C#N)C3=CC=CC=C3)C4=CC=CC=C4

InChIKey: GXIMOGHICAZEKA-UHFFFAOYSA-N

InChI: InChI=1S/C24H19N3/c25-16-21-22(19-12-6-2-7-13-19)23(20-14-8-3-9-15-20)27(24(21)26)17-18-10-4-1-5-11-18/h1-15H,17,26H2
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tert-Butyl 4-(3-methoxy-3-oxopropyl)-3，5-dimethyl-1H-pyrrole-2-carboxylate
- ≥95%
Cas Number: 60024-89-7 Compound CID: 291763

Formula: C₁₅H₂₃NO₄ Molecular Weight: 281.35

IUPAC Name: tert-butyl 4-(3-methoxy-3-oxopropyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate

SMILES: CC1=C(NC(=C1CCC(=O)OC)C)C(=O)OC(C)(C)C

InChIKey: NTLRHYGHGCUJGW-UHFFFAOYSA-N

InChI: InChI=1S/C15H23NO4/c1-9-11(7-8-12(17)19-6)10(2)16-13(9)14(18)20-15(3,4)5/h16H,7-8H2,1-6H3
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Siramesine
- ≥98%
Cas Number: 147817-50-3 Compound CID: 9829526

IUPAC Name: 1'-[4-[1-(4-fluorophenyl)indol-3-yl]butyl]spiro[1H-2-benzofuran-3,4'-piperidine]

SMILES: C1CN(CCC12C3=CC=CC=C3CO2)CCCCC4=CN(C5=CC=CC=C54)C6=CC=C(C=C6)F

InChIKey: XWAONOGAGZNUSF-UHFFFAOYSA-N

InChI: InChI=1S/C30H31FN2O/c31-25-12-14-26(15-13-25)33-21-23(27-9-2-4-11-29(27)33)7-5-6-18-32-19-16-30(17-20-32)28-10-3-1-8-24(28)22-34-30/h1-4,8-15,21H,5-7,show more
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Pyrrolnitrin
- ≥98%
Cas Number: 1018-71-9 EC Number: 213-812-7 Compound CID: 13916

IUPAC Name: 3-chloro-4-(3-chloro-2-nitrophenyl)-1H-pyrrole

SMILES: C1=CC(=C(C(=C1)Cl)[N+](=O)[O-])C2=CNC=C2Cl

InChIKey: QJBZDBLBQWFTPZ-UHFFFAOYSA-N

InChI: InChI=1S/C10H6Cl2N2O2/c11-8-3-1-2-6(10(8)14(15)16)7-4-13-5-9(7)12/h1-5,13H
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Methyl 4-(2，5-dimethyl-1H-pyrrol-1-yl)benzoate
- ≥98%
Cas Number: 26165-66-2 Compound CID: 738398

Formula: C₁₄H₁₅NO₂ Molecular Weight: 229.27

IUPAC Name: methyl 4-(2,5-dimethylpyrrol-1-yl)benzoate

SMILES: CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OC)C

InChIKey: FFRKCMKOLMHBCM-UHFFFAOYSA-N

InChI: InChI=1S/C14H15NO2/c1-10-4-5-11(2)15(10)13-8-6-12(7-9-13)14(16)17-3/h4-9H,1-3H3
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Methyl 3，4-dimethyl-1H-pyrrole-2-carboxylate
- ≥97%
Cas Number: 50634-33-8 Compound CID: 592724

IUPAC Name: methyl 3,4-dimethyl-1H-pyrrole-2-carboxylate

SMILES: CC1=CNC(=C1C)C(=O)OC

InChIKey: DNTZFFSVKAZNPR-UHFFFAOYSA-N

InChI: InChI=1S/C8H11NO2/c1-5-4-9-7(6(5)2)8(10)11-3/h4,9H,1-3H3
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Methyl 2-(1H-pyrrol-1-yl)benzoate
- ≥97%
Cas Number: 10333-67-2 Compound CID: 2776733

Formula: C₁₂H₁₁NO₂ Molecular Weight: 201.22

IUPAC Name: methyl 2-pyrrol-1-ylbenzoate

SMILES: COC(=O)C1=CC=CC=C1N2C=CC=C2

InChIKey: KUEYSLOCROREKF-UHFFFAOYSA-N

InChI: InChI=1S/C12H11NO2/c1-15-12(14)10-6-2-3-7-11(10)13-8-4-5-9-13/h2-9H,1H3
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