8-cyano-8,8-diphenyl-octanoic acid

Systemtic Name: 8-cyano-8,8-diphenyl-octanoic acid Openeye Name: 8-cyano-8,8-diphenyl-octanoic acid CAS Name: 8-cyano-8,8-diphenyloctanoic acid IUPAC Name: 8-cyano-8,8-diphenyloctanoic acid Traditional Name: 8-cyano-8,8-diphenyl-caprylic acid Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCCCCCC(=O)O)(C#N)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(CCCCCCC(=O)O)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C21H23NO2/c22-17-21(18-11-5-3-6-12-18,19-13-7-4-8-14-19)16-10-2-1-9-15-20(23)24/h3-8,11-14H,1-2,9-10,15-16H2,(H,23,24)