methyl 2-[(1R,2S,3R)-3-ethyl-2-(phenylcarbonyl)cyclohexyl]ethanoate

Systemtic Name: methyl 2-[(1R,2S,3R)-3-ethyl-2-(phenylcarbonyl)cyclohexyl]ethanoate Openeye Name: methyl 2-[(1R,2S,3R)-2-benzoyl-3-ethyl-cyclohexyl]acetate CAS Name: 2-[(1R,2S,3R)-2-benzoyl-3-ethylcyclohexyl]acetic acid methyl ester IUPAC Name: methyl 2-[(1R,2S,3R)-2-benzoyl-3-ethylcyclohexyl]acetate Traditional Name: 2-[(1R,2S,3R)-2-benzoyl-3-ethyl-cyclohexyl]acetic acid methyl ester Formula: C18H24O3 MolecularWeight: 288.38136

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC(C1C(=O)C2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H24O3/c1-3-13-10-7-11-15(12-16(19)21-2)17(13)18(20)14-8-5-4-6-9-14/h4-6,8-9,13,15,17H,3,7,10-12H2,1-2H3/t13-,15-,17+/m1/s1