[4-(4-cyanophenyl)phenyl] (4E)-3-methyl-4-[(3-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: [4-(4-cyanophenyl)phenyl] (4E)-3-methyl-4-[(3-methylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] (4E)-3-methyl-4-[(3-methylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[(3-methylphenyl)-oxomethyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] (4E)-3-methyl-4-[(3-methylbenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(m-toluoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C31H25N3O4 MolecularWeight: 503.5479

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NN=C2CCCC3=C2C(=C(O3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N/N=C/2\CCCC3=C2C(=C(O3)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N)C

InChI

InChI=1S/C31H25N3O4/c1-19-5-3-6-24(17-19)30(35)34-33-26-7-4-8-27-28(26)20(2)29(38-27)31(36)37-25-15-13-23(14-16-25)22-11-9-21(18-32)10-12-22/h3,5-6,9-17H,4,7-8H2,1-2H3,(H,34,35)/b33-26+