propyl 5-[3,5-bis(chloranyl)phenyl]-5-cyano-2-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: propyl 5-[3,5-bis(chloranyl)phenyl]-5-cyano-2-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: propyl 5-cyano-5-(3,5-dichlorophenyl)-2-oxo-cyclohexanecarboxylate CAS Name: 5-cyano-5-(3,5-dichlorophenyl)-2-oxo-1-cyclohexanecarboxylic acid propyl ester IUPAC Name: propyl 5-cyano-5-(3,5-dichlorophenyl)-2-oxocyclohexane-1-carboxylate Traditional Name: 5-cyano-5-(3,5-dichlorophenyl)-2-keto-cyclohexanecarboxylic acid propyl ester Formula: C17H17Cl2NO3 MolecularWeight: 354.22778

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1CC(CCC1=O)(C#N)C2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

CCCOC(=O)C1CC(CCC1=O)(C#N)C2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C17H17Cl2NO3/c1-2-5-23-16(22)14-9-17(10-20,4-3-15(14)21)11-6-12(18)8-13(19)7-11/h6-8,14H,2-5,9H2,1H3