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

Systemtic Name: 1-[(3,4-dichlorophenyl)-pyridin-4-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)-(4-pyridyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)-pyridin-4-ylmethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)-pyridin-4-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(3,4-dichlorophenyl)-(4-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=NC=C2)C3=CC(=C(C=C3)Cl)Cl)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H18Cl2N2O2/c19-15-4-3-13(10-16(15)20)17(12-5-7-21-8-6-12)22-9-1-2-14(11-22)18(23)24/h3-8,10,14,17H,1-2,9,11H2,(H,23,24)