[3-[(E)-(2-phenylethanoylhydrazinylidene)methyl]phenyl] 4-nitrobenzoate

Systemtic Name: [3-[(E)-(2-phenylethanoylhydrazinylidene)methyl]phenyl] 4-nitrobenzoate Openeye Name: [3-[(E)-[(2-phenylacetyl)hydrazono]methyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [3-[(E)-[(1-oxo-2-phenylethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[(2-phenylacetyl)hydrazinylidene]methyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-[(E)-[(2-phenylacetyl)hydrazono]methyl]phenyl] ester Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N3O5/c26-21(14-16-5-2-1-3-6-16)24-23-15-17-7-4-8-20(13-17)30-22(27)18-9-11-19(12-10-18)25(28)29/h1-13,15H,14H2,(H,24,26)/b23-15+