1-(3-aminocarbonyl-4-nitro-phenyl)piperidine-4-carboxylic acid

Systemtic Name: 1-(3-aminocarbonyl-4-nitro-phenyl)piperidine-4-carboxylic acid Openeye Name: 1-(3-carbamoyl-4-nitro-phenyl)piperidine-4-carboxylic acid CAS Name: 1-(3-carbamoyl-4-nitrophenyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(3-carbamoyl-4-nitrophenyl)piperidine-4-carboxylic acid Traditional Name: 1-(3-carbamoyl-4-nitro-phenyl)isonipecotic acid Formula: C13H15N3O5 MolecularWeight: 293.2753

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O5/c14-12(17)10-7-9(1-2-11(10)16(20)21)15-5-3-8(4-6-15)13(18)19/h1-2,7-8H,3-6H2,(H2,14,17)(H,18,19)