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

Systemtic Name: [4-(4-cyanophenyl)phenyl] (4E)-3-methyl-4-(phenylsulfonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: [4-(4-cyanophenyl)phenyl] (4E)-4-(benzenesulfonylhydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-4-(benzenesulfonylhydrazinylidene)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] (4E)-4-(benzenesulfonylhydrazinylidene)-3-methyl-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-4-(besylhydrazono)-3-methyl-6,7-dihydro-5H-benzofuran-2-carboxylic acid [4-(4-cyanophenyl)phenyl] ester Formula: C29H23N3O5S MolecularWeight: 525.57502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNS(=O)(=O)C3=CC=CC=C3)CCC2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NS(=O)(=O)C3=CC=CC=C3)/CCC2)C(=O)OC4=CC=C(C=C4)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H23N3O5S/c1-19-27-25(31-32-38(34,35)24-6-3-2-4-7-24)8-5-9-26(27)37-28(19)29(33)36-23-16-14-22(15-17-23)21-12-10-20(18-30)11-13-21/h2-4,6-7,10-17,32H,5,8-9H2,1H3/b31-25+