[4-[(E)-[(5-bromanylpyridin-3-yl)carbonylhydrazinylidene]methyl]-2-methoxy-3-nitro-phenyl] ethanoate

Systemtic Name: [4-[(E)-[(5-bromanylpyridin-3-yl)carbonylhydrazinylidene]methyl]-2-methoxy-3-nitro-phenyl] ethanoate Openeye Name: [4-[(E)-[(5-bromopyridine-3-carbonyl)hydrazono]methyl]-2-methoxy-3-nitro-phenyl] acetate CAS Name: acetic acid [4-[(E)-[[(5-bromo-3-pyridinyl)-oxomethyl]hydrazinylidene]methyl]-2-methoxy-3-nitrophenyl] ester IUPAC Name: [4-[(E)-[(5-bromopyridine-3-carbonyl)hydrazinylidene]methyl]-2-methoxy-3-nitrophenyl] acetate Traditional Name: acetic acid [4-[(E)-[(5-bromonicotinoyl)hydrazono]methyl]-2-methoxy-3-nitro-phenyl] ester Formula: C16H13BrN4O6 MolecularWeight: 437.20162

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C=C1)C=NNC(=O)C2=CC(=CN=C2)Br)[N+](=O)[O-])OC

Isomeric SMILES

CC(=O)OC1=C(C(=C(C=C1)/C=N/NC(=O)C2=CC(=CN=C2)Br)[N+](=O)[O-])OC

InChI

InChI=1S/C16H13BrN4O6/c1-9(22)27-13-4-3-10(14(21(24)25)15(13)26-2)7-19-20-16(23)11-5-12(17)8-18-6-11/h3-8H,1-2H3,(H,20,23)/b19-7+