ethyl (2E)-4-chloranyl-2-[(2-methyl-3-nitro-phenyl)hydrazinylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2E)-4-chloranyl-2-[(2-methyl-3-nitro-phenyl)hydrazinylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2E)-4-chloro-2-[(2-methyl-3-nitro-phenyl)hydrazono]-3-oxo-butanoate CAS Name: (2E)-4-chloro-2-[(2-methyl-3-nitrophenyl)hydrazinylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2E)-4-chloro-2-[(2-methyl-3-nitrophenyl)hydrazinylidene]-3-oxobutanoate Traditional Name: (2E)-4-chloro-3-keto-2-[(2-methyl-3-nitro-phenyl)hydrazono]butyric acid ethyl ester Formula: C13H14ClN3O5 MolecularWeight: 327.72036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=NNC1=C(C(=CC=C1)[N+](=O)[O-])C)C(=O)CCl

Isomeric SMILES

CCOC(=O)/C(=N/NC1=C(C(=CC=C1)[N+](=O)[O-])C)/C(=O)CCl

InChI

InChI=1S/C13H14ClN3O5/c1-3-22-13(19)12(11(18)7-14)16-15-9-5-4-6-10(8(9)2)17(20)21/h4-6,15H,3,7H2,1-2H3/b16-12+