potassium [nitro(phenyl)methyl] 1-carboxyoxypiperidine-4-carboxylate

Systemtic Name: potassium [nitro(phenyl)methyl] 1-carboxyoxypiperidine-4-carboxylate Openeye Name: potassium [nitro(phenyl)methyl] 1-carboxyoxypiperidine-4-carboxylate CAS Name: potassium 1-carboxyoxy-4-piperidinecarboxylic acid [nitro(phenyl)methyl] ester IUPAC Name: potassium [nitro(phenyl)methyl] 1-carboxyoxypiperidine-4-carboxylate Traditional Name: potassium 1-carboxyoxyisonipecotic acid [nitro(phenyl)methyl] ester Formula: C14H16KN2O7+ MolecularWeight: 363.38434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)[N+](=O)[O-])OC(=O)O.[K+]

Isomeric SMILES

C1CN(CCC1C(=O)OC(C2=CC=CC=C2)[N+](=O)[O-])OC(=O)O.[K+]

InChI

InChI=1S/C14H16N2O7.K/c17-13(11-6-8-15(9-7-11)23-14(18)19)22-12(16(20)21)10-4-2-1-3-5-10;/h1-5,11-12H,6-9H2,(H,18,19);/q;+1