ethyl (1R,4S)-1-methyl-2-oxidanylidene-4-[(E)-prop-1-enyl]cyclohexane-1-carboxylate

Systemtic Name: ethyl (1R,4S)-1-methyl-2-oxidanylidene-4-[(E)-prop-1-enyl]cyclohexane-1-carboxylate Openeye Name: ethyl (1R,4S)-1-methyl-2-oxo-4-[(E)-prop-1-enyl]cyclohexanecarboxylate CAS Name: (1R,4S)-1-methyl-2-oxo-4-[(E)-prop-1-enyl]-1-cyclohexanecarboxylic acid ethyl ester IUPAC Name: ethyl (1R,4S)-1-methyl-2-oxo-4-[(E)-prop-1-enyl]cyclohexane-1-carboxylate Traditional Name: (1R,4S)-2-keto-1-methyl-4-[(E)-prop-1-enyl]cyclohexanecarboxylic acid ethyl ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(CC1=O)C=CC)C

Isomeric SMILES

CCOC(=O)[C@@]1(CC[C@@H](CC1=O)/C=C/C)C

InChI

InChI=1S/C13H20O3/c1-4-6-10-7-8-13(3,11(14)9-10)12(15)16-5-2/h4,6,10H,5,7-9H2,1-3H3/b6-4+/t10-,13+/m0/s1