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

Systemtic Name: ethyl 3-[[1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrol-2-yl]carbonylamino]propanoate Openeye Name: ethyl 3-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]propanoate CAS Name: 3-[[[1-methyl-4-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-2-pyrrolyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[1-methyl-4-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]propanoate Traditional Name: 3-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]propionic acid ethyl ester Formula: C17H21N5O6 MolecularWeight: 391.37854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)C1=CC(=CN1C)NC(=O)C2=CC(=CN2C)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CCNC(=O)C1=CC(=CN1C)NC(=O)C2=CC(=CN2C)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O6/c1-4-28-15(23)5-6-18-16(24)13-7-11(9-20(13)2)19-17(25)14-8-12(22(26)27)10-21(14)3/h7-10H,4-6H2,1-3H3,(H,18,24)(H,19,25)