ethyl 2-(4-methylphenyl)sulfonyl-6,7-diphenyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: ethyl 2-(4-methylphenyl)sulfonyl-6,7-diphenyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: ethyl 6,7-diphenyl-2-(p-tolylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 2-(4-methylphenyl)sulfonyl-6,7-diphenyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-methylphenyl)sulfonyl-6,7-diphenyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 6,7-diphenyl-2-tosyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid ethyl ester Formula: C31H29NO4S MolecularWeight: 511.63126

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC2=C(CN1S(=O)(=O)C3=CC=C(C=C3)C)C=C(C(=C2)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCOC(=O)C1CC2=C(CN1S(=O)(=O)C3=CC=C(C=C3)C)C=C(C(=C2)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H29NO4S/c1-3-36-31(33)30-20-25-18-28(23-10-6-4-7-11-23)29(24-12-8-5-9-13-24)19-26(25)21-32(30)37(34,35)27-16-14-22(2)15-17-27/h4-19,30H,3,20-21H2,1-2H3