1-(2-nitrophenyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(2-nitrophenyl)piperidine-4-carboxylic acid Openeye Name: 1-(2-nitrophenyl)piperidine-4-carboxylic acid CAS Name: 1-(2-nitrophenyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(2-nitrophenyl)piperidine-4-carboxylic acid Traditional Name: 1-(2-nitrophenyl)isonipecotic acid Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2O4/c15-12(16)9-5-7-13(8-6-9)10-3-1-2-4-11(10)14(17)18/h1-4,9H,5-8H2,(H,15,16)