cyclohexyl 3-(1-cyano-2-oxidanylidene-3-phenyl-propyl)benzoate

Systemtic Name: cyclohexyl 3-(1-cyano-2-oxidanylidene-3-phenyl-propyl)benzoate Openeye Name: cyclohexyl 3-(1-cyano-2-oxo-3-phenyl-propyl)benzoate CAS Name: 3-(1-cyano-2-oxo-3-phenylpropyl)benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 3-(1-cyano-2-oxo-3-phenylpropyl)benzoate Traditional Name: 3-(1-cyano-2-keto-3-phenyl-propyl)benzoic acid cyclohexyl ester Formula: C23H23NO3 MolecularWeight: 361.43362

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC(=CC=C2)C(C#N)C(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC(=CC=C2)C(C#N)C(=O)CC3=CC=CC=C3

InChI

InChI=1S/C23H23NO3/c24-16-21(22(25)14-17-8-3-1-4-9-17)18-10-7-11-19(15-18)23(26)27-20-12-5-2-6-13-20/h1,3-4,7-11,15,20-21H,2,5-6,12-14H2