1-(3-methyl-5-nitro-imidazol-4-yl)piperidine-3-carboxylic acid

Systemtic Name: 1-(3-methyl-5-nitro-imidazol-4-yl)piperidine-3-carboxylic acid Openeye Name: 1-(3-methyl-5-nitro-imidazol-4-yl)piperidine-3-carboxylic acid CAS Name: 1-(3-methyl-5-nitro-4-imidazolyl)-3-piperidinecarboxylic acid IUPAC Name: 1-(3-methyl-5-nitroimidazol-4-yl)piperidine-3-carboxylic acid Traditional Name: 1-(3-methyl-5-nitro-imidazol-4-yl)nipecotic acid Formula: C10H14N4O4 MolecularWeight: 254.24256

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1N2CCCC(C2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1N2CCCC(C2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C10H14N4O4/c1-12-6-11-8(14(17)18)9(12)13-4-2-3-7(5-13)10(15)16/h6-7H,2-5H2,1H3,(H,15,16)