ethyl (E)-3-[(3-methoxy-4-nitro-1H-pyrazol-5-yl)carbonylamino]but-2-enoate

Systemtic Name: ethyl (E)-3-[(3-methoxy-4-nitro-1H-pyrazol-5-yl)carbonylamino]but-2-enoate Openeye Name: ethyl (E)-3-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]but-2-enoate CAS Name: (E)-3-[[(3-methoxy-4-nitro-1H-pyrazol-5-yl)-oxomethyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]but-2-enoate Traditional Name: (E)-3-[(3-methoxy-4-nitro-1H-pyrazole-5-carbonyl)amino]but-2-enoic acid ethyl ester Formula: C11H14N4O6 MolecularWeight: 298.25206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(=O)C1=C(C(=NN1)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(=O)C1=C(C(=NN1)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O6/c1-4-21-7(16)5-6(2)12-10(17)8-9(15(18)19)11(20-3)14-13-8/h5H,4H2,1-3H3,(H,12,17)(H,13,14)/b6-5+