3-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoic acid

Systemtic Name: 3-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoic acid Openeye Name: 3-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoic acid CAS Name: 3-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoic acid IUPAC Name: 3-(2-phenyl-4,5-dihydrobenzo[e]indol-3-yl)benzoic acid Traditional Name: 3-(2-phenyl-4,5-dihydrobenz[e]indol-3-yl)benzoic acid Formula: C25H19NO2 MolecularWeight: 365.42386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(N2C3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4)C5=CC=CC=C51

Isomeric SMILES

C1CC2=C(C=C(N2C3=CC=CC(=C3)C(=O)O)C4=CC=CC=C4)C5=CC=CC=C51

InChI

InChI=1S/C25H19NO2/c27-25(28)19-10-6-11-20(15-19)26-23-14-13-17-7-4-5-12-21(17)22(23)16-24(26)18-8-2-1-3-9-18/h1-12,15-16H,13-14H2,(H,27,28)