sodium 1-[(4-chlorophenyl)methyl]piperidine-4-carboxylate

Systemtic Name: sodium 1-[(4-chlorophenyl)methyl]piperidine-4-carboxylate Openeye Name: sodium 1-[(4-chlorophenyl)methyl]piperidine-4-carboxylate CAS Name: sodium 1-[(4-chlorophenyl)methyl]-4-piperidinecarboxylate IUPAC Name: sodium 1-[(4-chlorophenyl)methyl]piperidine-4-carboxylate Traditional Name: sodium 1-(4-chlorobenzyl)isonipecotate Formula: C13H15ClNNaO2 MolecularWeight: 275.70647

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)[O-])CC2=CC=C(C=C2)Cl.[Na+]

Isomeric SMILES

C1CN(CCC1C(=O)[O-])CC2=CC=C(C=C2)Cl.[Na+]

InChI

InChI=1S/C13H16ClNO2.Na/c14-12-3-1-10(2-4-12)9-15-7-5-11(6-8-15)13(16)17;/h1-4,11H,5-9H2,(H,16,17);/q;+1/p-1