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Tetrahydroisoquinolines
Description:
Tetrahydrogenated isoquinoline derivatives.
Ancestors:
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7-Methyl-1，2，3，4-Tetrahydroisoquinoline HydrochlorideCas Number: 41565-82-6 Compound CID: 45480214Formula: C10H14ClN Molecular Weight: 183.68IUPAC Name: 7-methyl-1,2,3,4-tetrahydroisoquinoline;hydrochlorideSMILES: CC1=CC2=C(CCNC2)C=C1.ClInChIKey: KCQZPRLKNXADRM-UHFFFAOYSA-NInChI: InChI=1S/C10H13N.ClH/c1-8-2-3-9-4-5-11-7-10(9)6-8;/h2-3,6,11H,4-5,7H2,1H3;1H -
7-(Trifluoromethyl)-1，2，3，4-tetrahydroisoquinoline-5-carbonitrilehydrochlorideCas Number: 1187830-66-5 Compound CID: 56777103Formula: C11H10ClF3N2 Molecular Weight: 262.66IUPAC Name: 7-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinoline-5-carbonitrile;hydrochlorideSMILES: C1CNCC2=C1C(=CC(=C2)C(F)(F)F)C#N.ClInChIKey: YMNDXSNYVDXFEA-UHFFFAOYSA-NInChI: InChI=1S/C11H9F3N2.ClH/c12-11(13,14)9-3-7(5-15)10-1-2-16-6-8(10)4-9;/h3-4,16H,1-2,6H2;1H
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7-(Trifluoromethyl)-1，2，3，4-tetrahydroisoquinolineCas Number: 199678-32-5 EC Number: 816-891-1Formula: C10H10F3N Molecular Weight: 201.19IUPAC Name: 7-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinolineSMILES: C1CNCC2=C1C=CC(=C2)C(F)(F)FInChIKey: NGQHLYGRTFVUEM-UHFFFAOYSA-NInChI: InChI=1S/C10H10F3N/c11-10(12,13)9-2-1-7-3-4-14-6-8(7)5-9/h1-2,5,14H,3-4,6H2 -
6-Methyl-5,6,7,8-tetrahydro-[1,3]dioxolo[4,5-g]isoquinolineCas Number: 494-55-3 Compound CID: 22301Formula: C11H13NO2 Molecular Weight: 191.23IUPAC Name: 6-methyl-7,8-dihydro-5H-[1,3]dioxolo[4,5-g]isoquinolineSMILES: CN1CCC2=CC3=C(C=C2C1)OCO3InChIKey: XNZFFRJWTVYMBF-UHFFFAOYSA-NInChI: InChI=1S/C11H13NO2/c1-12-3-2-8-4-10-11(14-7-13-10)5-9(8)6-12/h4-5H,2-3,6-7H2,1H3
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6-Methyl-1，2，3，4-tetrahydroisoquinoline hydrochlorideIUPAC Name: 6-methyl-1,2,3,4-tetrahydroisoquinoline;hydrochlorideSMILES: CC1=CC2=C(CNCC2)C=C1.ClInChIKey: HUYUCFMJAXNYMG-UHFFFAOYSA-NInChI: InChI=1S/C10H13N.ClH/c1-8-2-3-10-7-11-5-4-9(10)6-8;/h2-3,6,11H,4-5,7H2,1H3;1H
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6-(Trifluoromethyl)-1,2,3,4-tetrahydroisoquinolineCas Number: 284027-37-8Formula: C10H10F3N Molecular Weight: 201.19IUPAC Name: 6-(trifluoromethyl)-1,2,3,4-tetrahydroisoquinolineSMILES: C1CNCC2=C1C=C(C=C2)C(F)(F)FInChIKey: WOTVKLYMZOREFJ-UHFFFAOYSA-NInChI: InChI=1S/C10H10F3N/c11-10(12,13)9-2-1-8-6-14-4-3-7(8)5-9/h1-2,5,14H,3-4,6H2
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5-Chloro-1，2，3，4-tetrahydroisoquinoline hydrochlorideCas Number: 799274-05-8 Compound CID: 45074004Formula: C9H11Cl2N Molecular Weight: 204.09IUPAC Name: 5-chloro-1,2,3,4-tetrahydroisoquinoline;hydrochlorideSMILES: C1CNCC2=C1C(=CC=C2)Cl.ClInChIKey: ZEVFLDYXWYXNIX-UHFFFAOYSA-NInChI: InChI=1S/C9H10ClN.ClH/c10-9-3-1-2-7-6-11-5-4-8(7)9;/h1-3,11H,4-6H2;1H
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5-Chloro-1,2,3,4-tetrahydroisoquinolineCas Number: 73075-43-1 EC Number: 832-577-7Formula: C9H10ClN Molecular Weight: 167.63IUPAC Name: 5-chloro-1,2,3,4-tetrahydroisoquinolineSMILES: C1CNCC2=C1C(=CC=C2)ClInChIKey: OHOZWCJUZQXMAW-UHFFFAOYSA-NInChI: InChI=1S/C9H10ClN/c10-9-3-1-2-7-6-11-5-4-8(7)9/h1-3,11H,4-6H2
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2-Methyl-1，2，3，4-tetrahydroisoquinoline-3-carboxylic acidCas Number: 54329-54-3 Compound CID: 3157491Formula: C11H13NO2 Molecular Weight: 191.23IUPAC Name: 2-methyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acidSMILES: CN1CC2=CC=CC=C2CC1C(=O)OInChIKey: SKFOSDNQLGCEHM-UHFFFAOYSA-NInChI: InChI=1S/C11H13NO2/c1-12-7-9-5-3-2-4-8(9)6-10(12)11(13)14/h2-5,10H,6-7H2,1H3,(H,13,14)
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2-Boc-5-bromo-1，2，3，4-tetrahydroisoquinolin-8-amineCas Number: 1260763-55-0 Compound CID: 71748584Formula: C14H19BrN2O2 Molecular Weight: 327.22IUPAC Name: tert-butyl 8-amino-5-bromo-3,4-dihydro-1H-isoquinoline-2-carboxylateSMILES: CC(C)(C)OC(=O)N1CCC2=C(C=CC(=C2C1)N)BrInChIKey: DPCDGWCFUVLWBY-UHFFFAOYSA-NInChI: InChI=1S/C14H19BrN2O2/c1-14(2,3)19-13(18)17-7-6-9-10(8-17)12(16)5-4-11(9)15/h4-5H,6-8,16H2,1-3H3
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2-Boc-1，2，3，4-tetrahydroisoquinoline-1-carboxylic AcidCas Number: 166591-85-1 Compound CID: 15280723Formula: C15H19NO4IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-1-carboxylic acidSMILES: CC(C)(C)OC(=O)N1CCC2=CC=CC=C2C1C(=O)OInChIKey: KMTRFKAFNRHBCH-UHFFFAOYSA-NInChI: InChI=1S/C15H19NO4/c1-15(2,3)20-14(19)16-9-8-10-6-4-5-7-11(10)12(16)13(17)18/h4-7,12H,8-9H2,1-3H3,(H,17,18)
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2-Acetyl-1，2，3，4-tetrahydroisoquinoline-3-carboxylic AcidCas Number: 143767-54-8 Compound CID: 3305179Formula: C12H13NO3 Molecular Weight: 219.24IUPAC Name: 2-acetyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acidSMILES: CC(=O)N1CC2=CC=CC=C2CC1C(=O)OInChIKey: CNBQGXOEOOVTPA-UHFFFAOYSA-NInChI: InChI=1S/C12H13NO3/c1-8(14)13-7-10-5-3-2-4-9(10)6-11(13)12(15)16/h2-5,11H,6-7H2,1H3,(H,15,16)
