[4-[(E)-[2-(4-bromophenyl)ethanoylhydrazinylidene]methyl]-2-methoxy-3-nitro-phenyl] ethanoate

Systemtic Name: [4-[(E)-[2-(4-bromophenyl)ethanoylhydrazinylidene]methyl]-2-methoxy-3-nitro-phenyl] ethanoate Openeye Name: [4-[(E)-[[2-(4-bromophenyl)acetyl]hydrazono]methyl]-2-methoxy-3-nitro-phenyl] acetate CAS Name: acetic acid [4-[(E)-[[2-(4-bromophenyl)-1-oxoethyl]hydrazinylidene]methyl]-2-methoxy-3-nitrophenyl] ester IUPAC Name: [4-[(E)-[[2-(4-bromophenyl)acetyl]hydrazinylidene]methyl]-2-methoxy-3-nitrophenyl] acetate Traditional Name: acetic acid [4-[(E)-[[2-(4-bromophenyl)acetyl]hydrazono]methyl]-2-methoxy-3-nitro-phenyl] ester Formula: C18H16BrN3O6 MolecularWeight: 450.24014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C(=C(C=C1)C=NNC(=O)CC2=CC=C(C=C2)Br)[N+](=O)[O-])OC

Isomeric SMILES

CC(=O)OC1=C(C(=C(C=C1)/C=N/NC(=O)CC2=CC=C(C=C2)Br)[N+](=O)[O-])OC

InChI

InChI=1S/C18H16BrN3O6/c1-11(23)28-15-8-5-13(17(22(25)26)18(15)27-2)10-20-21-16(24)9-12-3-6-14(19)7-4-12/h3-8,10H,9H2,1-2H3,(H,21,24)/b20-10+