ethyl 2-[(1S,2R)-2-(2-oxidanylidenepropyl)cyclohexyl]prop-2-enoate

Systemtic Name: ethyl 2-[(1S,2R)-2-(2-oxidanylidenepropyl)cyclohexyl]prop-2-enoate Openeye Name: ethyl 2-[(1S,2R)-2-acetonylcyclohexyl]prop-2-enoate CAS Name: 2-[(1S,2R)-2-(2-oxopropyl)cyclohexyl]-2-propenoic acid ethyl ester IUPAC Name: ethyl 2-[(1S,2R)-2-(2-oxopropyl)cyclohexyl]prop-2-enoate Traditional Name: 2-[(1S,2R)-2-acetonylcyclohexyl]acrylic acid ethyl ester Formula: C14H22O3 MolecularWeight: 238.32268

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C)C1CCCCC1CC(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C14H22O3/c1-4-17-14(16)11(3)13-8-6-5-7-12(13)9-10(2)15/h12-13H,3-9H2,1-2H3/t12-,13-/m1/s1