bis[4-[(4-phenyldiazenylphenyl)iminomethyl]phenyl] 2-nitrobenzene-1,4-dicarboxylate

Systemtic Name: bis[4-[(4-phenyldiazenylphenyl)iminomethyl]phenyl] 2-nitrobenzene-1,4-dicarboxylate Openeye Name: bis[4-[(4-phenylazophenyl)iminomethyl]phenyl] 2-nitrobenzene-1,4-dicarboxylate CAS Name: 2-nitrobenzene-1,4-dicarboxylic acid bis[4-[(4-phenyldiazenylphenyl)iminomethyl]phenyl] ester IUPAC Name: bis[4-[(4-phenyldiazenylphenyl)iminomethyl]phenyl] 2-nitrobenzene-1,4-dicarboxylate Traditional Name: 2-nitrobenzene-1,4-dicarboxylic acid bis[4-[(4-phenylazophenyl)iminomethyl]phenyl] ester Formula: C46H31N7O6 MolecularWeight: 777.78164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=CC3=CC=C(C=C3)OC(=O)C4=CC(=C(C=C4)C(=O)OC5=CC=C(C=C5)C=NC6=CC=C(C=C6)N=NC7=CC=CC=C7)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)N=CC3=CC=C(C=C3)OC(=O)C4=CC(=C(C=C4)C(=O)OC5=CC=C(C=C5)C=NC6=CC=C(C=C6)N=NC7=CC=CC=C7)[N+](=O)[O-]

InChI

InChI=1S/C46H31N7O6/c54-45(58-41-24-11-32(12-25-41)30-47-35-16-20-39(21-17-35)51-49-37-7-3-1-4-8-37)34-15-28-43(44(29-34)53(56)57)46(55)59-42-26-13-33(14-27-42)31-48-36-18-22-40(23-19-36)52-50-38-9-5-2-6-10-38/h1-31H