1-(3-nitrophenyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(3-nitrophenyl)piperidine-4-carboxylic acid Openeye Name: 1-(3-nitrophenyl)piperidine-4-carboxylic acid CAS Name: 1-(3-nitrophenyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(3-nitrophenyl)piperidine-4-carboxylic acid Traditional Name: 1-(3-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)9-4-6-13(7-5-9)10-2-1-3-11(8-10)14(17)18/h1-3,8-9H,4-7H2,(H,15,16)