methyl (3S)-2-[5-chloranyl-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-methoxyphenyl)-2-oxidanylidene-indol-3-yl]-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: methyl (3S)-2-[5-chloranyl-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-methoxyphenyl)-2-oxidanylidene-indol-3-yl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: methyl (3S)-2-[5-chloro-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-methoxyphenyl)-2-oxo-indolin-3-yl]-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3S)-2-[5-chloro-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-methoxyphenyl)-2-oxo-3-indolyl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (3S)-2-[5-chloro-1-(2,4-dimethoxyphenyl)sulfonyl-3-(2-methoxyphenyl)-2-oxoindol-3-yl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3S)-2-[5-chloro-1-(2,4-dimethoxyphenyl)sulfonyl-2-keto-3-(2-methoxyphenyl)indolin-3-yl]-3,4-dihydro-1H-isoquinoline-3-carboxylic acid methyl ester Formula: C34H31ClN2O8S MolecularWeight: 663.13654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)Cl)C(C2=O)(C4=CC=CC=C4OC)N5CC6=CC=CC=C6CC5C(=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)N2C3=C(C=C(C=C3)Cl)C(C2=O)(C4=CC=CC=C4OC)N5CC6=CC=CC=C6C[C@H]5C(=O)OC)OC

InChI

InChI=1S/C34H31ClN2O8S/c1-42-24-14-16-31(30(19-24)44-3)46(40,41)37-27-15-13-23(35)18-26(27)34(33(37)39,25-11-7-8-12-29(25)43-2)36-20-22-10-6-5-9-21(22)17-28(36)32(38)45-4/h5-16,18-19,28H,17,20H2,1-4H3/t28-,34?/m0/s1