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

Systemtic Name: (2-oxidanylidenecyclohexyl) 3-[3-(2,3-dihydroindol-1-ylsulfonyl)-4,5-dimethoxy-phenyl]prop-2-enoate Openeye Name: (2-oxocyclohexyl) 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 (2-oxocyclohexyl) ester IUPAC Name: (2-oxocyclohexyl) 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 (2-ketocyclohexyl) ester Formula: C25H27NO7S MolecularWeight: 485.54938

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)OC2CCCCC2=O)S(=O)(=O)N3CCC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=CC(=O)OC2CCCCC2=O)S(=O)(=O)N3CCC4=CC=CC=C43)OC

InChI

InChI=1S/C25H27NO7S/c1-31-22-15-17(11-12-24(28)33-21-10-6-5-9-20(21)27)16-23(25(22)32-2)34(29,30)26-14-13-18-7-3-4-8-19(18)26/h3-4,7-8,11-12,15-16,21H,5-6,9-10,13-14H2,1-2H3