methyl 1-[(4-chlorophenyl)methyl]-3,3-dimethyl-2-oxidanylidene-cyclopentane-1-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C1=O)(CC2=CC=C(C=C2)Cl)C(=O)OC)C

Isomeric SMILES

CC1(CCC(C1=O)(CC2=CC=C(C=C2)Cl)C(=O)OC)C

InChI

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