(1-cyano-2-methyl-cyclohexyl) benzoate

Systemtic Name: (1-cyano-2-methyl-cyclohexyl) benzoate Openeye Name: (1-cyano-2-methyl-cyclohexyl) benzoate CAS Name: benzoic acid (1-cyano-2-methylcyclohexyl) ester IUPAC Name: (1-cyano-2-methylcyclohexyl) benzoate Traditional Name: benzoic acid (1-cyano-2-methyl-cyclohexyl) ester Formula: C15H17NO2 MolecularWeight: 243.30098

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1(C#N)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CC1CCCCC1(C#N)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H17NO2/c1-12-7-5-6-10-15(12,11-16)18-14(17)13-8-3-2-4-9-13/h2-4,8-9,12H,5-7,10H2,1H3