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

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

Systemtic Name:ethyl (E)-3-[3-(3-nitropyrazol-1-yl)propanoylamino]but-2-enoate
Openeye Name:ethyl (E)-3-[3-(3-nitropyrazol-1-yl)propanoylamino]but-2-enoate
CAS Name:(E)-3-[[3-(3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-2-butenoic acid ethyl ester
IUPAC Name:ethyl (E)-3-[3-(3-nitropyrazol-1-yl)propanoylamino]but-2-enoate
Traditional Name:(E)-3-[3-(3-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=CC(=N1)[N+](=O)[O-]


Isomeric SMILES

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


InChI

InChI=1S/C12H16N4O5/c1-3-21-12(18)8-9(2)13-11(17)5-7-15-6-4-10(14-15)16(19)20/h4,6,8H,3,5,7H2,1-2H3,(H,13,17)/b9-8+


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