1-[[2,5-bis(chloranyl)phenyl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[2,5-bis(chloranyl)phenyl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[(2,5-dichlorophenyl)methyl]piperidine-4-carboxylic acid CAS Name: 1-[(2,5-dichlorophenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[(2,5-dichlorophenyl)methyl]piperidine-4-carboxylic acid Traditional Name: 1-(2,5-dichlorobenzyl)isonipecotic acid Formula: C13H15Cl2NO2 MolecularWeight: 288.1697

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15Cl2NO2/c14-11-1-2-12(15)10(7-11)8-16-5-3-9(4-6-16)13(17)18/h1-2,7,9H,3-6,8H2,(H,17,18)