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

Systemtic Name: 2-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]butanoic acid Openeye Name: 2-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]butanoic acid CAS Name: 2-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]butanoic acid IUPAC Name: 2-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]butanoic acid Traditional Name: 2-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]butyric acid Formula: C10H13N3O5 MolecularWeight: 255.22732

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)C1=CC(=CN1C)[N+](=O)[O-]

Isomeric SMILES

CCC(C(=O)O)NC(=O)C1=CC(=CN1C)[N+](=O)[O-]

InChI

InChI=1S/C10H13N3O5/c1-3-7(10(15)16)11-9(14)8-4-6(13(17)18)5-12(8)2/h4-5,7H,3H2,1-2H3,(H,11,14)(H,15,16)