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

Systemtic Name: methyl 2-[(1-methyl-4-nitro-pyrrol-2-yl)carbonylamino]benzoate Openeye Name: methyl 2-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]benzoate CAS Name: 2-[[(1-methyl-4-nitro-2-pyrrolyl)-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-methyl-4-nitropyrrole-2-carbonyl)amino]benzoate Traditional Name: 2-[(1-methyl-4-nitro-pyrrole-2-carbonyl)amino]benzoic acid methyl ester Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC2=CC=CC=C2C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O5/c1-16-8-9(17(20)21)7-12(16)13(18)15-11-6-4-3-5-10(11)14(19)22-2/h3-8H,1-2H3,(H,15,18)