ethyl (E)-3-[[2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanoyl]amino]but-2-enoate

Systemtic Name: ethyl (E)-3-[[2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanoyl]amino]but-2-enoate Openeye Name: ethyl (E)-3-[[2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanoyl]amino]but-2-enoate CAS Name: (E)-3-[[2-methyl-3-(5-methyl-3-nitro-1-pyrazolyl)-1-oxopropyl]amino]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[[2-methyl-3-(5-methyl-3-nitropyrazol-1-yl)propanoyl]amino]but-2-enoate Traditional Name: (E)-3-[[2-methyl-3-(5-methyl-3-nitro-pyrazol-1-yl)propanoyl]amino]but-2-enoic acid ethyl ester Formula: C14H20N4O5 MolecularWeight: 324.3324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N4O5/c1-5-23-13(19)6-10(3)15-14(20)9(2)8-17-11(4)7-12(16-17)18(21)22/h6-7,9H,5,8H2,1-4H3,(H,15,20)/b10-6+