methyl 3-[(4-chlorophenyl)methyl]-2-oxidanylidene-1-propan-2-yl-cyclopentane-1-carboxylate

Systemtic Name: methyl 3-[(4-chlorophenyl)methyl]-2-oxidanylidene-1-propan-2-yl-cyclopentane-1-carboxylate Openeye Name: methyl 3-[(4-chlorophenyl)methyl]-1-isopropyl-2-oxo-cyclopentanecarboxylate CAS Name: 3-[(4-chlorophenyl)methyl]-2-oxo-1-propan-2-yl-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 3-[(4-chlorophenyl)methyl]-2-oxo-1-propan-2-ylcyclopentane-1-carboxylate Traditional Name: 3-(4-chlorobenzyl)-1-isopropyl-2-keto-cyclopentanecarboxylic acid methyl ester Formula: C17H21ClO3 MolecularWeight: 308.79984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21ClO3/c1-11(2)17(16(20)21-3)9-8-13(15(17)19)10-12-4-6-14(18)7-5-12/h4-7,11,13H,8-10H2,1-3H3