methyl 6-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]hexanoate

Systemtic Name: methyl 6-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]hexanoate Openeye Name: methyl 6-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]hexanoate CAS Name: 6-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]hexanoate Traditional Name: 6-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]hexanoic acid methyl ester Formula: C13H19N3O5 MolecularWeight: 297.30706

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NCCCCCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NCCCCCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O5/c1-15-9-10(16(19)20)8-11(15)13(18)14-7-5-3-4-6-12(17)21-2/h8-9H,3-7H2,1-2H3,(H,14,18)