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

Systemtic Name: 1-[2-(3,4-dichlorophenyl)ethanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-(3,4-dichlorophenyl)acetyl]piperidine-3-carboxylic acid CAS Name: 1-[2-(3,4-dichlorophenyl)-1-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-(3,4-dichlorophenyl)acetyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-(3,4-dichlorophenyl)acetyl]nipecotic acid Formula: C14H15Cl2NO3 MolecularWeight: 316.1798

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CC2=CC(=C(C=C2)Cl)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)CC2=CC(=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C14H15Cl2NO3/c15-11-4-3-9(6-12(11)16)7-13(18)17-5-1-2-10(8-17)14(19)20/h3-4,6,10H,1-2,5,7-8H2,(H,19,20)