(4-cyanophenyl)methyl 3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxy-phenyl]prop-2-enoate

Systemtic Name: (4-cyanophenyl)methyl 3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxy-phenyl]prop-2-enoate Openeye Name: (4-cyanophenyl)methyl 3-(3-indolin-1-ylsulfonyl-4,5-dimethoxy-phenyl)prop-2-enoate CAS Name: 3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxyphenyl]-2-propenoic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxyphenyl]prop-2-enoate Traditional Name: 3-(3-indolin-1-ylsulfonyl-4,5-dimethoxy-phenyl)acrylic acid (4-cyanobenzyl) ester Formula: C27H24N2O6S MolecularWeight: 504.55426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)OCC2=CC=C(C=C2)C#N)S(=O)(=O)N3CCC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=CC(=O)OCC2=CC=C(C=C2)C#N)S(=O)(=O)N3CCC4=CC=CC=C43)OC

InChI

InChI=1S/C27H24N2O6S/c1-33-24-15-21(11-12-26(30)35-18-20-9-7-19(17-28)8-10-20)16-25(27(24)34-2)36(31,32)29-14-13-22-5-3-4-6-23(22)29/h3-12,15-16H,13-14,18H2,1-2H3