1-[(4-chlorophenyl)methyl]-2-oxidanylidene-cycloheptane-1-carboxylic acid

Systemtic Name: 1-[(4-chlorophenyl)methyl]-2-oxidanylidene-cycloheptane-1-carboxylic acid Openeye Name: 1-[(4-chlorophenyl)methyl]-2-oxo-cycloheptanecarboxylic acid CAS Name: 1-[(4-chlorophenyl)methyl]-2-oxo-1-cycloheptanecarboxylic acid IUPAC Name: 1-[(4-chlorophenyl)methyl]-2-oxocycloheptane-1-carboxylic acid Traditional Name: 1-(4-chlorobenzyl)-2-keto-cycloheptanecarboxylic acid Formula: C15H17ClO3 MolecularWeight: 280.74668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(CC1)(CC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1CCC(=O)C(CC1)(CC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H17ClO3/c16-12-7-5-11(6-8-12)10-15(14(18)19)9-3-1-2-4-13(15)17/h5-8H,1-4,9-10H2,(H,18,19)