(phenylmethyl) (2S)-2-(cyclohexylmethyl)-4-oxidanylidene-butanoate

Systemtic Name: (phenylmethyl) (2S)-2-(cyclohexylmethyl)-4-oxidanylidene-butanoate Openeye Name: benzyl (2S)-2-(cyclohexylmethyl)-4-oxo-butanoate CAS Name: (2S)-2-(cyclohexylmethyl)-4-oxobutanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-(cyclohexylmethyl)-4-oxobutanoate Traditional Name: (2S)-2-(cyclohexylmethyl)-4-keto-butyric acid benzyl ester Formula: C18H24O3 MolecularWeight: 288.38136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC=O)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CCC(CC1)C[C@@H](CC=O)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H24O3/c19-12-11-17(13-15-7-3-1-4-8-15)18(20)21-14-16-9-5-2-6-10-16/h2,5-6,9-10,12,15,17H,1,3-4,7-8,11,13-14H2/t17-/m1/s1