1-[(2,4-dichlorophenyl)-pyridin-4-yl-methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2,4-dichlorophenyl)-pyridin-4-yl-methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2,4-dichlorophenyl)-(4-pyridyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2,4-dichlorophenyl)-pyridin-4-ylmethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2,4-dichlorophenyl)-pyridin-4-ylmethyl]piperidine-3-carboxylic acid Traditional Name: 1-[(2,4-dichlorophenyl)-(4-pyridyl)methyl]nipecotic acid Formula: C18H18Cl2N2O2 MolecularWeight: 365.25372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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