3-[2-(4-cyanophenyl)benzo[e]indol-3-yl]benzoic acid

Systemtic Name: 3-[2-(4-cyanophenyl)benzo[e]indol-3-yl]benzoic acid Openeye Name: 3-[2-(4-cyanophenyl)benzo[e]indol-3-yl]benzoic acid CAS Name: 3-[2-(4-cyanophenyl)-3-benzo[e]indolyl]benzoic acid IUPAC Name: 3-[2-(4-cyanophenyl)benzo[e]indol-3-yl]benzoic acid Traditional Name: 3-[2-(4-cyanophenyl)benz[e]indol-3-yl]benzoic acid Formula: C26H16N2O2 MolecularWeight: 388.41744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C=C(N3C4=CC=CC(=C4)C(=O)O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C=C(N3C4=CC=CC(=C4)C(=O)O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C26H16N2O2/c27-16-17-8-10-19(11-9-17)25-15-23-22-7-2-1-4-18(22)12-13-24(23)28(25)21-6-3-5-20(14-21)26(29)30/h1-15H,(H,29,30)