(phenylmethyl) 4-(3-cyano-4-cyclohexyl-phenyl)-2-oxidanyl-butanoate

Systemtic Name: (phenylmethyl) 4-(3-cyano-4-cyclohexyl-phenyl)-2-oxidanyl-butanoate Openeye Name: benzyl 4-(3-cyano-4-cyclohexyl-phenyl)-2-hydroxy-butanoate CAS Name: 4-(3-cyano-4-cyclohexylphenyl)-2-hydroxybutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-cyano-4-cyclohexylphenyl)-2-hydroxybutanoate Traditional Name: 4-(3-cyano-4-cyclohexyl-phenyl)-2-hydroxy-butyric acid benzyl ester Formula: C24H27NO3 MolecularWeight: 377.47608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=C(C=C2)CCC(C(=O)OCC3=CC=CC=C3)O)C#N

Isomeric SMILES

C1CCC(CC1)C2=C(C=C(C=C2)CCC(C(=O)OCC3=CC=CC=C3)O)C#N

InChI

InChI=1S/C24H27NO3/c25-16-21-15-18(11-13-22(21)20-9-5-2-6-10-20)12-14-23(26)24(27)28-17-19-7-3-1-4-8-19/h1,3-4,7-8,11,13,15,20,23,26H,2,5-6,9-10,12,14,17H2