1-(3-nitrophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: 1-(3-nitrophenyl)carbonylpiperidine-4-carboxylate Openeye Name: 1-(3-nitrobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(3-nitrophenyl)-oxomethyl]-4-piperidinecarboxylate IUPAC Name: 1-(3-nitrobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(3-nitrobenzoyl)isonipecotate Formula: C13H13N2O5- MolecularWeight: 277.25272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O5/c16-12(10-2-1-3-11(8-10)15(19)20)14-6-4-9(5-7-14)13(17)18/h1-3,8-9H,4-7H2,(H,17,18)/p-1