methyl (1R,3S)-4-methylidene-3-(phenylcarbonyl)cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,3S)-4-methylidene-3-(phenylcarbonyl)cyclohexane-1-carboxylate Openeye Name: methyl (1R,3S)-3-benzoyl-4-methylene-cyclohexanecarboxylate CAS Name: (1R,3S)-3-benzoyl-4-methylene-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,3S)-3-benzoyl-4-methylidenecyclohexane-1-carboxylate Traditional Name: (1R,3S)-3-benzoyl-4-methylene-cyclohexanecarboxylic acid methyl ester Formula: C16H18O3 MolecularWeight: 258.31232

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCC(=C)C(C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)[C@@H]1CCC(=C)[C@H](C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H18O3/c1-11-8-9-13(16(18)19-2)10-14(11)15(17)12-6-4-3-5-7-12/h3-7,13-14H,1,8-10H2,2H3/t13-,14+/m1/s1