methyl 2-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(4-nitro-1H-pyrrol-2-yl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]propanoate CAS Name: 3-hydroxy-2-[[(4-nitro-1H-pyrrol-2-yl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]propanoate Traditional Name: 3-hydroxy-2-[(4-nitro-1H-pyrrole-2-carbonyl)amino]propionic acid methyl ester Formula: C9H11N3O6 MolecularWeight: 257.20014

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC(=CN1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC(=CN1)[N+](=O)[O-]

InChI

InChI=1S/C9H11N3O6/c1-18-9(15)7(4-13)11-8(14)6-2-5(3-10-6)12(16)17/h2-3,7,10,13H,4H2,1H3,(H,11,14)