1-[3-(2,4-dichlorophenyl)propanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[3-(2,4-dichlorophenyl)propanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[3-(2,4-dichlorophenyl)propanoyl]piperidine-3-carboxylic acid CAS Name: 1-[3-(2,4-dichlorophenyl)-1-oxopropyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[3-(2,4-dichlorophenyl)propanoyl]piperidine-3-carboxylic acid Traditional Name: 1-[3-(2,4-dichlorophenyl)propanoyl]nipecotic acid Formula: C15H17Cl2NO3 MolecularWeight: 330.20638

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCC2=C(C=C(C=C2)Cl)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)CCC2=C(C=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C15H17Cl2NO3/c16-12-5-3-10(13(17)8-12)4-6-14(19)18-7-1-2-11(9-18)15(20)21/h3,5,8,11H,1-2,4,6-7,9H2,(H,20,21)