methyl 3-methyl-2-[(1-methyl-5-nitro-pyrrol-2-yl)carbonylamino]butanoate

Systemtic Name: methyl 3-methyl-2-[(1-methyl-5-nitro-pyrrol-2-yl)carbonylamino]butanoate Openeye Name: methyl 3-methyl-2-[(1-methyl-5-nitro-pyrrole-2-carbonyl)amino]butanoate CAS Name: 3-methyl-2-[[(1-methyl-5-nitro-2-pyrrolyl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[(1-methyl-5-nitropyrrole-2-carbonyl)amino]butanoate Traditional Name: 3-methyl-2-[(1-methyl-5-nitro-pyrrole-2-carbonyl)amino]butyric acid methyl ester Formula: C12H17N3O5 MolecularWeight: 283.28048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=CC=C(N1C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=O)C1=CC=C(N1C)[N+](=O)[O-]

InChI

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