4-[4-[5-(2-methylphenyl)-3,4-dihydro-2H-pyrrol-2-yl]phenyl]benzoic acid

Systemtic Name: 4-[4-[5-(2-methylphenyl)-3,4-dihydro-2H-pyrrol-2-yl]phenyl]benzoic acid Openeye Name: 4-[4-[5-(o-tolyl)-3,4-dihydro-2H-pyrrol-2-yl]phenyl]benzoic acid CAS Name: 4-[4-[5-(2-methylphenyl)-3,4-dihydro-2H-pyrrol-2-yl]phenyl]benzoic acid IUPAC Name: 4-[4-[5-(2-methylphenyl)-3,4-dihydro-2H-pyrrol-2-yl]phenyl]benzoic acid Traditional Name: 4-[4-[5-(o-tolyl)-1-pyrrolin-2-yl]phenyl]benzoic acid Formula: C24H21NO2 MolecularWeight: 355.42904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(CC2)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NC(CC2)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H21NO2/c1-16-4-2-3-5-21(16)23-15-14-22(25-23)19-10-6-17(7-11-19)18-8-12-20(13-9-18)24(26)27/h2-13,22H,14-15H2,1H3,(H,26,27)