[4-[(4-bromophenyl)iminomethyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [4-[(4-bromophenyl)iminomethyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [4-[(4-bromophenyl)iminomethyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [4-[(4-bromophenyl)iminomethyl]phenyl] ester IUPAC Name: [4-[(4-bromophenyl)iminomethyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [4-[(4-bromophenyl)iminomethyl]phenyl] ester Formula: C20H12BrN3O6 MolecularWeight: 470.22978

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NC2=CC=C(C=C2)Br)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=NC2=CC=C(C=C2)Br)OC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H12BrN3O6/c21-15-3-5-16(6-4-15)22-12-13-1-7-19(8-2-13)30-20(25)14-9-17(23(26)27)11-18(10-14)24(28)29/h1-12H