[4-[(E)-[(4-bromophenyl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenyl] 4-nitrobenzoate

Systemtic Name: [4-[(E)-[(4-bromophenyl)carbonylhydrazinylidene]methyl]-2-ethoxy-phenyl] 4-nitrobenzoate Openeye Name: [4-[(E)-[(4-bromobenzoyl)hydrazono]methyl]-2-ethoxy-phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[(E)-[[(4-bromophenyl)-oxomethyl]hydrazinylidene]methyl]-2-ethoxyphenyl] ester IUPAC Name: [4-[(E)-[(4-bromobenzoyl)hydrazinylidene]methyl]-2-ethoxyphenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[(E)-[(4-bromobenzoyl)hydrazono]methyl]-2-ethoxy-phenyl] ester Formula: C23H18BrN3O6 MolecularWeight: 512.30952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=NNC(=O)C2=CC=C(C=C2)Br)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=C(C=C2)Br)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H18BrN3O6/c1-2-32-21-13-15(14-25-26-22(28)16-4-8-18(24)9-5-16)3-12-20(21)33-23(29)17-6-10-19(11-7-17)27(30)31/h3-14H,2H2,1H3,(H,26,28)/b25-14+