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

Systemtic Name: ethyl 4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]pyrrol-2-yl]carbonylamino]butanoate Openeye Name: ethyl 4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]butanoate CAS Name: 4-[[[1-methyl-4-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]-2-pyrrolyl]-oxomethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[1-methyl-4-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]butanoate Traditional Name: 4-[[1-methyl-4-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]pyrrole-2-carbonyl]amino]butyric acid ethyl ester Formula: C18H23N5O6 MolecularWeight: 405.40512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5O6/c1-4-29-16(24)6-5-7-19-17(25)14-8-12(10-21(14)2)20-18(26)15-9-13(23(27)28)11-22(15)3/h8-11H,4-7H2,1-3H3,(H,19,25)(H,20,26)