ethyl (1Z)-N-[4-cyano-2-methyl-5-(5-nitrofuran-2-yl)pyrazol-3-yl]ethanimidate

Systemtic Name: ethyl (1Z)-N-[4-cyano-2-methyl-5-(5-nitrofuran-2-yl)pyrazol-3-yl]ethanimidate Openeye Name: ethyl (1Z)-N-[4-cyano-2-methyl-5-(5-nitro-2-furyl)pyrazol-3-yl]ethanimidate CAS Name: (1Z)-N-[4-cyano-2-methyl-5-(5-nitro-2-furanyl)-3-pyrazolyl]ethanimidic acid ethyl ester IUPAC Name: ethyl (1Z)-N-[4-cyano-2-methyl-5-(5-nitrofuran-2-yl)pyrazol-3-yl]ethanimidate Traditional Name: (1Z)-N-[4-cyano-2-methyl-5-(5-nitro-2-furyl)pyrazol-3-yl]acetimidic acid ethyl ester Formula: C13H13N5O4 MolecularWeight: 303.27342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NC1=C(C(=NN1C)C2=CC=C(O2)[N+](=O)[O-])C#N)C

Isomeric SMILES

CCO/C(=N\C1=C(C(=NN1C)C2=CC=C(O2)[N+](=O)[O-])C#N)/C

InChI

InChI=1S/C13H13N5O4/c1-4-21-8(2)15-13-9(7-14)12(16-17(13)3)10-5-6-11(22-10)18(19)20/h5-6H,4H2,1-3H3/b15-8-