4-[1-cyano-2-[1-(naphthalen-1-ylmethyl)indol-3-yl]ethenyl]benzoic acid

Systemtic Name: 4-[1-cyano-2-[1-(naphthalen-1-ylmethyl)indol-3-yl]ethenyl]benzoic acid Openeye Name: 4-[1-cyano-2-[1-(1-naphthylmethyl)indol-3-yl]vinyl]benzoic acid CAS Name: 4-[1-cyano-2-[1-(1-naphthalenylmethyl)-3-indolyl]ethenyl]benzoic acid IUPAC Name: 4-[1-cyano-2-[1-(naphthalen-1-ylmethyl)indol-3-yl]ethenyl]benzoic acid Traditional Name: 4-[1-cyano-2-[1-(1-naphthylmethyl)indol-3-yl]vinyl]benzoic acid Formula: C29H20N2O2 MolecularWeight: 428.4813

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C4=CC=CC=C43)C=C(C#N)C5=CC=C(C=C5)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CN3C=C(C4=CC=CC=C43)C=C(C#N)C5=CC=C(C=C5)C(=O)O

InChI

InChI=1S/C29H20N2O2/c30-17-24(20-12-14-22(15-13-20)29(32)33)16-25-19-31(28-11-4-3-10-27(25)28)18-23-8-5-7-21-6-1-2-9-26(21)23/h1-16,19H,18H2,(H,32,33)