1-[2-(3,4-dichlorophenyl)-2-methyl-4-oxidanylidene-butanoyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[2-(3,4-dichlorophenyl)-2-methyl-4-oxidanylidene-butanoyl]piperidine-4-carboxylic acid Openeye Name: 1-[2-(3,4-dichlorophenyl)-2-methyl-4-oxo-butanoyl]piperidine-4-carboxylic acid CAS Name: 1-[2-(3,4-dichlorophenyl)-2-methyl-1,4-dioxobutyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[2-(3,4-dichlorophenyl)-2-methyl-4-oxobutanoyl]piperidine-4-carboxylic acid Traditional Name: 1-[2-(3,4-dichlorophenyl)-4-keto-2-methyl-butanoyl]isonipecotic acid Formula: C17H19Cl2NO4 MolecularWeight: 372.24306

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC=O)(C1=CC(=C(C=C1)Cl)Cl)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC(CC=O)(C1=CC(=C(C=C1)Cl)Cl)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C17H19Cl2NO4/c1-17(6-9-21,12-2-3-13(18)14(19)10-12)16(24)20-7-4-11(5-8-20)15(22)23/h2-3,9-11H,4-8H2,1H3,(H,22,23)