4-[5-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]-2,3-dihydroindol-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]-2,3-dihydroindol-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]indolin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[5-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]-2,3-dihydroindol-1-yl]-4-oxobutanoic acid IUPAC Name: 4-[5-[2-(3,4-dimethoxyphenyl)ethylsulfamoyl]-2,3-dihydroindol-1-yl]-4-oxobutanoic acid Traditional Name: 4-[5-(homoveratrylsulfamoyl)indolin-1-yl]-4-keto-butyric acid Formula: C22H26N2O7S MolecularWeight: 462.51604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)CCC(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC3=C(C=C2)N(CC3)C(=O)CCC(=O)O)OC

InChI

InChI=1S/C22H26N2O7S/c1-30-19-6-3-15(13-20(19)31-2)9-11-23-32(28,29)17-4-5-18-16(14-17)10-12-24(18)21(25)7-8-22(26)27/h3-6,13-14,23H,7-12H2,1-2H3,(H,26,27)