2-[3-[1-(phenylsulfonyl)indol-3-yl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[1-(phenylsulfonyl)indol-3-yl]phenyl]ethanoic acid Openeye Name: 2-[3-[1-(benzenesulfonyl)indol-3-yl]phenyl]acetic acid CAS Name: 2-[3-[1-(benzenesulfonyl)-3-indolyl]phenyl]acetic acid IUPAC Name: 2-[3-[1-(benzenesulfonyl)indol-3-yl]phenyl]acetic acid Traditional Name: 2-[3-(1-besylindol-3-yl)phenyl]acetic acid Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C4=CC(=CC=C4)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C4=CC(=CC=C4)CC(=O)O

InChI

InChI=1S/C22H17NO4S/c24-22(25)14-16-7-6-8-17(13-16)20-15-23(21-12-5-4-11-19(20)21)28(26,27)18-9-2-1-3-10-18/h1-13,15H,14H2,(H,24,25)