5-[2-(4-methylphenyl)-4,5,6,7-tetrahydroindol-1-yl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-(4-methylphenyl)-4,5,6,7-tetrahydroindol-1-yl]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[2-(p-tolyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid CAS Name: 2-hydroxy-5-[2-(4-methylphenyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid IUPAC Name: 2-hydroxy-5-[2-(4-methylphenyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid Traditional Name: 2-hydroxy-5-[2-(p-tolyl)-4,5,6,7-tetrahydroindol-1-yl]benzoic acid Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC3=C(N2C4=CC(=C(C=C4)O)C(=O)O)CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC3=C(N2C4=CC(=C(C=C4)O)C(=O)O)CCCC3

InChI

InChI=1S/C22H21NO3/c1-14-6-8-15(9-7-14)20-12-16-4-2-3-5-19(16)23(20)17-10-11-21(24)18(13-17)22(25)26/h6-13,24H,2-5H2,1H3,(H,25,26)