4-(2,3-dicyanophenyl)-4-(phenylmethyl)cyclohexane-1-carboxylic acid

Systemtic Name: 4-(2,3-dicyanophenyl)-4-(phenylmethyl)cyclohexane-1-carboxylic acid Openeye Name: 4-benzyl-4-(2,3-dicyanophenyl)cyclohexanecarboxylic acid CAS Name: 4-(2,3-dicyanophenyl)-4-(phenylmethyl)-1-cyclohexanecarboxylic acid IUPAC Name: 4-benzyl-4-(2,3-dicyanophenyl)cyclohexane-1-carboxylic acid Traditional Name: 4-benzyl-4-(2,3-dicyanophenyl)cyclohexanecarboxylic acid Formula: C22H20N2O2 MolecularWeight: 344.4064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)(CC2=CC=CC=C2)C3=CC=CC(=C3C#N)C#N

Isomeric SMILES

C1CC(CCC1C(=O)O)(CC2=CC=CC=C2)C3=CC=CC(=C3C#N)C#N

InChI

InChI=1S/C22H20N2O2/c23-14-18-7-4-8-20(19(18)15-24)22(13-16-5-2-1-3-6-16)11-9-17(10-12-22)21(25)26/h1-8,17H,9-13H2,(H,25,26)