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

Systemtic Name: methyl 2-methyl-2-[(1-methyl-5-nitro-pyrrol-2-yl)carbonylamino]pentanoate Openeye Name: methyl 2-methyl-2-[(1-methyl-5-nitro-pyrrole-2-carbonyl)amino]pentanoate CAS Name: 2-methyl-2-[[(1-methyl-5-nitro-2-pyrrolyl)-oxomethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 2-methyl-2-[(1-methyl-5-nitropyrrole-2-carbonyl)amino]pentanoate Traditional Name: 2-methyl-2-[(1-methyl-5-nitro-pyrrole-2-carbonyl)amino]valeric acid methyl ester Formula: C13H19N3O5 MolecularWeight: 297.30706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O5/c1-5-8-13(2,12(18)21-4)14-11(17)9-6-7-10(15(9)3)16(19)20/h6-7H,5,8H2,1-4H3,(H,14,17)