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

Systemtic Name: methyl 2-[(1-cyclopropyl-4-nitro-pyrrol-2-yl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 2-[(1-cyclopropyl-4-nitro-pyrrole-2-carbonyl)amino]-3-hydroxy-propanoate CAS Name: 2-[[(1-cyclopropyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl 2-[(1-cyclopropyl-4-nitropyrrole-2-carbonyl)amino]-3-hydroxypropanoate Traditional Name: 2-[(1-cyclopropyl-4-nitro-pyrrole-2-carbonyl)amino]-3-hydroxy-propionic acid methyl ester Formula: C12H15N3O6 MolecularWeight: 297.264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC(=CN1C2CC2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC(=CN1C2CC2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O6/c1-21-12(18)9(6-16)13-11(17)10-4-8(15(19)20)5-14(10)7-2-3-7/h4-5,7,9,16H,2-3,6H2,1H3,(H,13,17)