1-[2-[(5-chloranylpyridin-2-yl)-methyl-amino]ethanoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[2-[(5-chloranylpyridin-2-yl)-methyl-amino]ethanoyl]piperidine-3-carboxylic acid Openeye Name: 1-[2-[(5-chloro-2-pyridyl)-methyl-amino]acetyl]piperidine-3-carboxylic acid CAS Name: 1-[2-[(5-chloro-2-pyridinyl)-methylamino]-1-oxoethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[2-[(5-chloropyridin-2-yl)-methylamino]acetyl]piperidine-3-carboxylic acid Traditional Name: 1-[2-[(5-chloro-2-pyridyl)-methyl-amino]acetyl]nipecotic acid Formula: C14H18ClN3O3 MolecularWeight: 311.76402

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCCC(C1)C(=O)O)C2=NC=C(C=C2)Cl

Isomeric SMILES

CN(CC(=O)N1CCCC(C1)C(=O)O)C2=NC=C(C=C2)Cl

InChI

InChI=1S/C14H18ClN3O3/c1-17(12-5-4-11(15)7-16-12)9-13(19)18-6-2-3-10(8-18)14(20)21/h4-5,7,10H,2-3,6,8-9H2,1H3,(H,20,21)