tert-butyl 1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrole-2-carboxylate

Systemtic Name: tert-butyl 1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrole-2-carboxylate Openeye Name: tert-butyl 1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carboxylate CAS Name: 1-methyl-4-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-2-pyrrolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-methyl-4-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrrole-2-carboxylate Traditional Name: 1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carboxylic acid tert-butyl ester Formula: C16H20N4O5 MolecularWeight: 348.3538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=CN1C)NC(=O)C2=CC(=CN2C)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=CN1C)NC(=O)C2=CC(=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C16H20N4O5/c1-16(2,3)25-15(22)13-6-10(8-18(13)4)17-14(21)12-7-11(20(23)24)9-19(12)5/h6-9H,1-5H3,(H,17,21)