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

Systemtic Name: [3-[(E)-(dibutylhydrazinylidene)methyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [3-[(E)-(dibutylhydrazono)methyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [3-[(E)-(dibutylhydrazinylidene)methyl]phenyl] ester IUPAC Name: [3-[(E)-(dibutylhydrazinylidene)methyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [3-[(E)-(dibutylhydrazono)methyl]phenyl] ester Formula: C22H26N4O6 MolecularWeight: 442.46504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)N=CC1=CC(=CC=C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O6/c1-3-5-10-24(11-6-4-2)23-16-17-8-7-9-21(12-17)32-22(27)18-13-19(25(28)29)15-20(14-18)26(30)31/h7-9,12-16H,3-6,10-11H2,1-2H3/b23-16+