1-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]nipecotic acid Formula: C15H19ClN2O3 MolecularWeight: 310.77596

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)NCC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC(=O)NCC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H19ClN2O3/c16-13-5-3-11(4-6-13)8-17-14(19)10-18-7-1-2-12(9-18)15(20)21/h3-6,12H,1-2,7-10H2,(H,17,19)(H,20,21)