7-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]heptanoic acid

Systemtic Name: 7-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]heptanoic acid Openeye Name: 7-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]heptanoic acid CAS Name: 7-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]heptanoic acid IUPAC Name: 7-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]heptanoic acid Traditional Name: 7-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]enanthic acid Formula: C13H19N3O5 MolecularWeight: 297.30706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCCCCCC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCCCCCC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O5/c1-15-9-10(16(20)21)8-11(15)13(19)14-7-5-3-2-4-6-12(17)18/h8-9H,2-7H2,1H3,(H,14,19)(H,17,18)