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

Systemtic Name: (phenylmethyl) 3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxy-phenyl]prop-2-enoate Openeye Name: benzyl 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 (phenylmethyl) ester IUPAC Name: benzyl 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 benzyl ester Formula: C26H25NO6S MolecularWeight: 479.5448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H25NO6S/c1-31-23-16-20(12-13-25(28)33-18-19-8-4-3-5-9-19)17-24(26(23)32-2)34(29,30)27-15-14-21-10-6-7-11-22(21)27/h3-13,16-17H,14-15,18H2,1-2H3