1-(6-azanyl-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid

Systemtic Name: 1-(6-azanyl-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid Openeye Name: 1-(6-amino-5-nitro-pyrimidin-4-yl)piperidine-4-carboxylic acid CAS Name: 1-(6-amino-5-nitro-4-pyrimidinyl)-4-piperidinecarboxylic acid IUPAC Name: 1-(6-amino-5-nitropyrimidin-4-yl)piperidine-4-carboxylic acid Traditional Name: 1-(6-amino-5-nitro-pyrimidin-4-yl)isonipecotic acid Formula: C10H13N5O4 MolecularWeight: 267.24132

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)O)C2=C(C(=NC=N2)N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)O)C2=C(C(=NC=N2)N)[N+](=O)[O-]

InChI

InChI=1S/C10H13N5O4/c11-8-7(15(18)19)9(13-5-12-8)14-3-1-6(2-4-14)10(16)17/h5-6H,1-4H2,(H,16,17)(H2,11,12,13)