methyl (1R,5S)-3-[2-(4-chlorophenyl)ethyl]-5-methyl-2-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: methyl (1R,5S)-3-[2-(4-chlorophenyl)ethyl]-5-methyl-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: methyl (1R,5S)-3-[2-(4-chlorophenyl)ethyl]-5-methyl-2-oxo-cyclopentanecarboxylate CAS Name: (1R,5S)-3-[2-(4-chlorophenyl)ethyl]-5-methyl-2-oxo-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-3-[2-(4-chlorophenyl)ethyl]-5-methyl-2-oxocyclopentane-1-carboxylate Traditional Name: (1R,5S)-3-[2-(4-chlorophenyl)ethyl]-2-keto-5-methyl-cyclopentanecarboxylic acid methyl ester Formula: C16H19ClO3 MolecularWeight: 294.77326

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)C1C(=O)OC)CCC2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@H]1CC(C(=O)[C@@H]1C(=O)OC)CCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H19ClO3/c1-10-9-12(15(18)14(10)16(19)20-2)6-3-11-4-7-13(17)8-5-11/h4-5,7-8,10,12,14H,3,6,9H2,1-2H3/t10-,12?,14+/m0/s1