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

Systemtic Name: ethyl (E)-3-[2-(3-nitropyrazol-1-yl)ethanoylamino]but-2-enoate Openeye Name: ethyl (E)-3-[[2-(3-nitropyrazol-1-yl)acetyl]amino]but-2-enoate CAS Name: (E)-3-[[2-(3-nitro-1-pyrazolyl)-1-oxoethyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[[2-(3-nitropyrazol-1-yl)acetyl]amino]but-2-enoate Traditional Name: (E)-3-[[2-(3-nitropyrazol-1-yl)acetyl]amino]but-2-enoic acid ethyl ester Formula: C11H14N4O5 MolecularWeight: 282.25266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)NC(=O)CN1C=CC(=N1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C(\C)/NC(=O)CN1C=CC(=N1)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O5/c1-3-20-11(17)6-8(2)12-10(16)7-14-5-4-9(13-14)15(18)19/h4-6H,3,7H2,1-2H3,(H,12,16)/b8-6+