methyl 4-[(E)-[2-(4-chloranyl-2-nitro-phenoxy)ethanoylhydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[(E)-[2-(4-chloranyl-2-nitro-phenoxy)ethanoylhydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[(E)-[[2-(4-chloro-2-nitro-phenoxy)acetyl]hydrazono]methyl]benzoate CAS Name: 4-[(E)-[[2-(4-chloro-2-nitrophenoxy)-1-oxoethyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-[[2-(4-chloro-2-nitrophenoxy)acetyl]hydrazinylidene]methyl]benzoate Traditional Name: 4-[(E)-[[2-(4-chloro-2-nitro-phenoxy)acetyl]hydrazono]methyl]benzoic acid methyl ester Formula: C17H14ClN3O6 MolecularWeight: 391.76256

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C=NNC(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)/C=N/NC(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H14ClN3O6/c1-26-17(23)12-4-2-11(3-5-12)9-19-20-16(22)10-27-15-7-6-13(18)8-14(15)21(24)25/h2-9H,10H2,1H3,(H,20,22)/b19-9+