ethyl (3E)-2-ethyl-3-[2-(4-nitrophenoxy)ethanoylhydrazinylidene]butanoate

Systemtic Name: ethyl (3E)-2-ethyl-3-[2-(4-nitrophenoxy)ethanoylhydrazinylidene]butanoate Openeye Name: ethyl (3E)-2-ethyl-3-[[2-(4-nitrophenoxy)acetyl]hydrazono]butanoate CAS Name: (3E)-2-ethyl-3-[[2-(4-nitrophenoxy)-1-oxoethyl]hydrazinylidene]butanoic acid ethyl ester IUPAC Name: ethyl (3E)-2-ethyl-3-[[2-(4-nitrophenoxy)acetyl]hydrazinylidene]butanoate Traditional Name: (3E)-2-ethyl-3-[[2-(4-nitrophenoxy)acetyl]hydrazono]butyric acid ethyl ester Formula: C16H21N3O6 MolecularWeight: 351.35444

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=NNC(=O)COC1=CC=C(C=C1)[N+](=O)[O-])C)C(=O)OCC

Isomeric SMILES

CCC(/C(=N/NC(=O)COC1=CC=C(C=C1)[N+](=O)[O-])/C)C(=O)OCC

InChI

InChI=1S/C16H21N3O6/c1-4-14(16(21)24-5-2)11(3)17-18-15(20)10-25-13-8-6-12(7-9-13)19(22)23/h6-9,14H,4-5,10H2,1-3H3,(H,18,20)/b17-11+