2-[[2-(3,4-dimethylphenyl)-1,3-dihydroisoindol-5-yl]amino]benzoic acid

Systemtic Name: 2-[[2-(3,4-dimethylphenyl)-1,3-dihydroisoindol-5-yl]amino]benzoic acid Openeye Name: 2-[[2-(3,4-dimethylphenyl)isoindolin-5-yl]amino]benzoic acid CAS Name: 2-[[2-(3,4-dimethylphenyl)-1,3-dihydroisoindol-5-yl]amino]benzoic acid IUPAC Name: 2-[[2-(3,4-dimethylphenyl)-1,3-dihydroisoindol-5-yl]amino]benzoic acid Traditional Name: 2-[[2-(3,4-dimethylphenyl)isoindolin-5-yl]amino]benzoic acid Formula: C23H22N2O2 MolecularWeight: 358.43298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC3=C(C2)C=C(C=C3)NC4=CC=CC=C4C(=O)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC3=C(C2)C=C(C=C3)NC4=CC=CC=C4C(=O)O)C

InChI

InChI=1S/C23H22N2O2/c1-15-7-10-20(11-16(15)2)25-13-17-8-9-19(12-18(17)14-25)24-22-6-4-3-5-21(22)23(26)27/h3-12,24H,13-14H2,1-2H3,(H,26,27)