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

Systemtic Name: [4-(4-cyanophenyl)phenyl] (4E)-4-(2,2-diphenylethanoylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] (4E)-4-[(2,2-diphenylacetyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[(1-oxo-2,2-diphenylethyl)hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] (4E)-4-[(2,2-diphenylacetyl)hydrazinylidene]-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-[(2,2-diphenylacetyl)hydrazono]-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C37H29N3O4 MolecularWeight: 579.64386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)CCC2)C(=O)OC5=CC=C(C=C5)C6=CC=C(C=C6)C#N

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4)/CCC2)C(=O)OC5=CC=C(C=C5)C6=CC=C(C=C6)C#N

InChI

InChI=1S/C37H29N3O4/c1-24-33-31(39-40-36(41)34(28-9-4-2-5-10-28)29-11-6-3-7-12-29)13-8-14-32(33)44-35(24)37(42)43-30-21-19-27(20-22-30)26-17-15-25(23-38)16-18-26/h2-7,9-12,15-22,34H,8,13-14H2,1H3,(H,40,41)/b39-31+