5-(5-methyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(5-methyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-(5-methyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid CAS Name: 2-hydroxy-5-(5-methyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid IUPAC Name: 2-hydroxy-5-(5-methyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid Traditional Name: 2-hydroxy-5-(5-methyl-2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid Formula: C22H21NO3 MolecularWeight: 347.40704

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C=C(N2C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1CCC2=C(C1)C=C(N2C3=CC(=C(C=C3)O)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C22H21NO3/c1-14-7-9-19-16(11-14)12-20(15-5-3-2-4-6-15)23(19)17-8-10-21(24)18(13-17)22(25)26/h2-6,8,10,12-14,24H,7,9,11H2,1H3,(H,25,26)