methyl (3E)-2-[cyano-(4-nitrophenyl)methyl]-3-(methoxycarbonylhydrazinylidene)butanoate

Systemtic Name: methyl (3E)-2-[cyano-(4-nitrophenyl)methyl]-3-(methoxycarbonylhydrazinylidene)butanoate Openeye Name: methyl (3E)-2-[cyano-(4-nitrophenyl)methyl]-3-(methoxycarbonylhydrazono)butanoate CAS Name: (3E)-2-[cyano-(4-nitrophenyl)methyl]-3-(methoxycarbonylhydrazinylidene)butanoic acid methyl ester IUPAC Name: methyl (3E)-2-[cyano-(4-nitrophenyl)methyl]-3-(methoxycarbonylhydrazinylidene)butanoate Traditional Name: (3E)-3-(carbomethoxyhydrazono)-2-[cyano-(4-nitrophenyl)methyl]butyric acid methyl ester Formula: C15H16N4O6 MolecularWeight: 348.31074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)OC)C(C(C#N)C1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

C/C(=N\NC(=O)OC)/C(C(C#N)C1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C15H16N4O6/c1-9(17-18-15(21)25-3)13(14(20)24-2)12(8-16)10-4-6-11(7-5-10)19(22)23/h4-7,12-13H,1-3H3,(H,18,21)/b17-9+