[2-[(E)-[(4-benzamidophenyl)carbonylhydrazinylidene]methyl]phenyl] 3,5-dinitrobenzoate

Systemtic Name: [2-[(E)-[(4-benzamidophenyl)carbonylhydrazinylidene]methyl]phenyl] 3,5-dinitrobenzoate Openeye Name: [2-[(E)-[(4-benzamidobenzoyl)hydrazono]methyl]phenyl] 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid [2-[(E)-[[(4-benzamidophenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-[(E)-[(4-benzamidobenzoyl)hydrazinylidene]methyl]phenyl] 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid [2-[(E)-[(4-benzamidobenzoyl)hydrazono]methyl]phenyl] ester Formula: C28H19N5O8 MolecularWeight: 553.47916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NN=CC3=CC=CC=C3OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)N/N=C/C3=CC=CC=C3OC(=O)C4=CC(=CC(=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C28H19N5O8/c34-26(18-6-2-1-3-7-18)30-22-12-10-19(11-13-22)27(35)31-29-17-20-8-4-5-9-25(20)41-28(36)21-14-23(32(37)38)16-24(15-21)33(39)40/h1-17H,(H,30,34)(H,31,35)/b29-17+