[3-[(E)-[(4-methylphenyl)carbonylhydrazinylidene]methyl]phenyl] 4-nitrobenzoate

Systemtic Name: [3-[(E)-[(4-methylphenyl)carbonylhydrazinylidene]methyl]phenyl] 4-nitrobenzoate Openeye Name: [3-[(E)-[(4-methylbenzoyl)hydrazono]methyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [3-[(E)-[[(4-methylphenyl)-oxomethyl]hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[(4-methylbenzoyl)hydrazinylidene]methyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-[(E)-(p-toluoylhydrazono)methyl]phenyl] ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NN=CC2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/N=C/C2=CC(=CC=C2)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O5/c1-15-5-7-17(8-6-15)21(26)24-23-14-16-3-2-4-20(13-16)30-22(27)18-9-11-19(12-10-18)25(28)29/h2-14H,1H3,(H,24,26)/b23-14+