1-[4-[4-(4-aminophenyl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid

Systemtic Name: 1-[4-[4-(4-aminophenyl)-1-oxidanyl-1-oxidanylidene-butan-2-yl]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid Openeye Name: 1-[4-[3-(4-aminophenyl)-1-carboxy-propyl]phenyl]sulfonylindoline-2-carboxylic acid CAS Name: 1-[4-[4-(4-aminophenyl)-1-hydroxy-1-oxobutan-2-yl]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid IUPAC Name: 1-[4-[4-(4-aminophenyl)-1-hydroxy-1-oxobutan-2-yl]phenyl]sulfonyl-2,3-dihydroindole-2-carboxylic acid Traditional Name: 1-[4-[3-(4-aminophenyl)-1-carboxy-propyl]phenyl]sulfonylindoline-2-carboxylic acid Formula: C25H24N2O6S MolecularWeight: 480.53286

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(CCC4=CC=C(C=C4)N)C(=O)O)C(=O)O

Isomeric SMILES

C1C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C(CCC4=CC=C(C=C4)N)C(=O)O)C(=O)O

InChI

InChI=1S/C25H24N2O6S/c26-19-10-5-16(6-11-19)7-14-21(24(28)29)17-8-12-20(13-9-17)34(32,33)27-22-4-2-1-3-18(22)15-23(27)25(30)31/h1-6,8-13,21,23H,7,14-15,26H2,(H,28,29)(H,30,31)