(1-carbazol-9-yl-1-oxidanylidene-butan-2-yl) 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate

Systemtic Name: (1-carbazol-9-yl-1-oxidanylidene-butan-2-yl) 4-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinoline-3-carboxylate Openeye Name: 1-(carbazole-9-carbonyl)propyl 4-(4-chlorophenyl)-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-methyl-1-oxo-3-isoquinolinecarboxylic acid [1-(9-carbazolyl)-1-oxobutan-2-yl] ester IUPAC Name: (1-carbazol-9-yl-1-oxobutan-2-yl) 4-(4-chlorophenyl)-2-methyl-1-oxoisoquinoline-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-1-keto-2-methyl-isoquinoline-3-carboxylic acid 1-(carbazole-9-carbonyl)propyl ester Formula: C33H25ClN2O4 MolecularWeight: 549.0156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)OC(=O)C4=C(C5=CC=CC=C5C(=O)N4C)C6=CC=C(C=C6)Cl

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)OC(=O)C4=C(C5=CC=CC=C5C(=O)N4C)C6=CC=C(C=C6)Cl

InChI

InChI=1S/C33H25ClN2O4/c1-3-28(32(38)36-26-14-8-6-10-22(26)23-11-7-9-15-27(23)36)40-33(39)30-29(20-16-18-21(34)19-17-20)24-12-4-5-13-25(24)31(37)35(30)2/h4-19,28H,3H2,1-2H3