methyl (1S,2R)-2-[(2S)-1-oxidanylidene-1-phenyl-propan-2-yl]cyclohexane-1-carboxylate

Systemtic Name: methyl (1S,2R)-2-[(2S)-1-oxidanylidene-1-phenyl-propan-2-yl]cyclohexane-1-carboxylate Openeye Name: methyl (1S,2R)-2-[(1S)-1-methyl-2-oxo-2-phenyl-ethyl]cyclohexanecarboxylate CAS Name: (1S,2R)-2-[(2S)-1-oxo-1-phenylpropan-2-yl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1S,2R)-2-[(2S)-1-oxo-1-phenylpropan-2-yl]cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-[(1S)-2-keto-1-methyl-2-phenyl-ethyl]cyclohexanecarboxylic acid methyl ester Formula: C17H22O3 MolecularWeight: 274.35478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1C(=O)OC)C(=O)C2=CC=CC=C2

Isomeric SMILES

C[C@@H]([C@H]1CCCC[C@@H]1C(=O)OC)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C17H22O3/c1-12(16(18)13-8-4-3-5-9-13)14-10-6-7-11-15(14)17(19)20-2/h3-5,8-9,12,14-15H,6-7,10-11H2,1-2H3/t12-,14+,15-/m0/s1