2-[3-[1-(4-methylphenyl)sulfonylindol-3-yl]phenyl]ethanoic acid

Systemtic Name: 2-[3-[1-(4-methylphenyl)sulfonylindol-3-yl]phenyl]ethanoic acid Openeye Name: 2-[3-[1-(p-tolylsulfonyl)indol-3-yl]phenyl]acetic acid CAS Name: 2-[3-[1-(4-methylphenyl)sulfonyl-3-indolyl]phenyl]acetic acid IUPAC Name: 2-[3-[1-(4-methylphenyl)sulfonylindol-3-yl]phenyl]acetic acid Traditional Name: 2-[3-(1-tosylindol-3-yl)phenyl]acetic acid Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C4=CC(=CC=C4)CC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=CC=CC=C32)C4=CC(=CC=C4)CC(=O)O

InChI

InChI=1S/C23H19NO4S/c1-16-9-11-19(12-10-16)29(27,28)24-15-21(20-7-2-3-8-22(20)24)18-6-4-5-17(13-18)14-23(25)26/h2-13,15H,14H2,1H3,(H,25,26)