methyl 3-methyl-2-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]butanoate Openeye Name: methyl 3-methyl-2-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]butanoate CAS Name: 3-methyl-2-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]butanoate Traditional Name: 3-methyl-2-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]butyric acid methyl ester Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17N3O5/c1-7(2)10(12(17)20-4)13-11(16)9-5-8(15(18)19)6-14(9)3/h5-7,10H,1-4H3,(H,13,16)