1-[[3,5-bis(chloranyl)phenyl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[3,5-bis(chloranyl)phenyl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(3,5-dichlorophenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(3,5-dichlorophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(3,5-dichlorophenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(3,5-dichlorobenzyl)isonipecotic acid Formula: C13H15Cl2NO2 MolecularWeight: 288.1697

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)CC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

C1CN(CCC1C(=O)O)CC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C13H15Cl2NO2/c14-11-5-9(6-12(15)7-11)8-16-3-1-10(2-4-16)13(17)18/h5-7,10H,1-4,8H2,(H,17,18)