[4-[(E)-(phenylhydrazinylidene)methyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [4-[(E)-(phenylhydrazinylidene)methyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [4-[(E)-(phenylhydrazono)methyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [4-[(E)-(phenylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(phenylhydrazinylidene)methyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [4-[(E)-(phenylhydrazono)methyl]phenyl] ester Formula: C20H14N4O6 MolecularWeight: 406.34836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14N4O6/c25-20(15-10-17(23(26)27)12-18(11-15)24(28)29)30-19-8-6-14(7-9-19)13-21-22-16-4-2-1-3-5-16/h1-13,22H/b21-13+