3-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid

Systemtic Name: 3-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid Openeye Name: 3-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid CAS Name: 3-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid IUPAC Name: 3-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid Traditional Name: 3-(2-phenyl-4,5,6,7-tetrahydroindol-1-yl)benzoic acid Formula: C21H19NO2 MolecularWeight: 317.38106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(N2C3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C=C(N2C3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C21H19NO2/c23-21(24)17-10-6-11-18(13-17)22-19-12-5-4-9-16(19)14-20(22)15-7-2-1-3-8-15/h1-3,6-8,10-11,13-14H,4-5,9,12H2,(H,23,24)