[4-[(Z)-[2-(4-bromophenyl)ethanoylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-nitrobenzoate

Systemtic Name: [4-[(Z)-[2-(4-bromophenyl)ethanoylhydrazinylidene]methyl]-2-methoxy-phenyl] 4-nitrobenzoate Openeye Name: [4-[(Z)-[[2-(4-bromophenyl)acetyl]hydrazono]methyl]-2-methoxy-phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(Z)-[[2-(4-bromophenyl)-1-oxoethyl]hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(Z)-[[2-(4-bromophenyl)acetyl]hydrazinylidene]methyl]-2-methoxyphenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[(Z)-[[2-(4-bromophenyl)acetyl]hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C23H18BrN3O6 MolecularWeight: 512.30952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC(=O)CC2=CC=C(C=C2)Br)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N\NC(=O)CC2=CC=C(C=C2)Br)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H18BrN3O6/c1-32-21-12-16(14-25-26-22(28)13-15-2-7-18(24)8-3-15)4-11-20(21)33-23(29)17-5-9-19(10-6-17)27(30)31/h2-12,14H,13H2,1H3,(H,26,28)/b25-14-