[4-bromanyl-2-[(Z)-[(4-nitrophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-bromanylbenzoate

Systemtic Name: [4-bromanyl-2-[(Z)-[(4-nitrophenyl)carbonylhydrazinylidene]methyl]phenyl] 4-bromanylbenzoate Openeye Name: [4-bromo-2-[(Z)-[(4-nitrobenzoyl)hydrazono]methyl]phenyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [4-bromo-2-[(Z)-[[(4-nitrophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [4-bromo-2-[(Z)-[(4-nitrobenzoyl)hydrazinylidene]methyl]phenyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [4-bromo-2-[(Z)-[(4-nitrobenzoyl)hydrazono]methyl]phenyl] ester Formula: C21H13Br2N3O5 MolecularWeight: 547.15302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NN=CC2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)N/N=C\C2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C21H13Br2N3O5/c22-16-5-1-14(2-6-16)21(28)31-19-10-7-17(23)11-15(19)12-24-25-20(27)13-3-8-18(9-4-13)26(29)30/h1-12H,(H,25,27)/b24-12-