1-[(3,4-dichlorophenyl)-pyridin-3-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)-pyridin-3-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)-(3-pyridyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)-(3-pyridinyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)-pyridin-3-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3,4-dichlorophenyl)-(3-pyridyl)methyl]nipecotic acid Formula: C18H18Cl2N2O2 MolecularWeight: 365.25372

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(C2=CC(=C(C=C2)Cl)Cl)C3=CN=CC=C3)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(C2=CC(=C(C=C2)Cl)Cl)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C18H18Cl2N2O2/c19-15-6-5-12(9-16(15)20)17(13-3-1-7-21-10-13)22-8-2-4-14(11-22)18(23)24/h1,3,5-7,9-10,14,17H,2,4,8,11H2,(H,23,24)