[3-[(E)-(2-phenylethanoylhydrazinylidene)methyl]phenyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [3-[(E)-(2-phenylethanoylhydrazinylidene)methyl]phenyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [3-[(E)-[(2-phenylacetyl)hydrazono]methyl]phenyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [3-[(E)-[(1-oxo-2-phenylethyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [3-[(E)-[(2-phenylacetyl)hydrazinylidene]methyl]phenyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [3-[(E)-[(2-phenylacetyl)hydrazono]methyl]phenyl] ester Formula: C23H18N2O5 MolecularWeight: 402.39942

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC=CC(=C3)C=NNC(=O)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OC3=CC=CC(=C3)/C=N/NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H18N2O5/c26-22(12-16-5-2-1-3-6-16)25-24-14-17-7-4-8-19(11-17)30-23(27)18-9-10-20-21(13-18)29-15-28-20/h1-11,13-14H,12,15H2,(H,25,26)/b24-14+