ethyl (E)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]but-2-enoate

Systemtic Name: ethyl (E)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]but-2-enoate Openeye Name: ethyl (E)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]but-2-enoate CAS Name: (E)-3-[[3-(4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]but-2-enoate Traditional Name: (E)-3-[3-(4-nitropyrazol-1-yl)propanoylamino]but-2-enoic acid ethyl ester Formula: C12H16N4O5 MolecularWeight: 296.27924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(=O)CCN1C=C(C=N1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(=O)CCN1C=C(C=N1)[N+](=O)[O-]

InChI

InChI=1S/C12H16N4O5/c1-3-21-12(18)6-9(2)14-11(17)4-5-15-8-10(7-13-15)16(19)20/h6-8H,3-5H2,1-2H3,(H,14,17)/b9-6+