propan-2-yl (4E)-3-methyl-4-(phenylsulfonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: propan-2-yl (4E)-3-methyl-4-(phenylsulfonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: isopropyl (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 propan-2-yl ester IUPAC Name: propan-2-yl (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 isopropyl ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNS(=O)(=O)C3=CC=CC=C3)CCC2)C(=O)OC(C)C

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NS(=O)(=O)C3=CC=CC=C3)/CCC2)C(=O)OC(C)C

InChI

InChI=1S/C19H22N2O5S/c1-12(2)25-19(22)18-13(3)17-15(10-7-11-16(17)26-18)20-21-27(23,24)14-8-5-4-6-9-14/h4-6,8-9,12,21H,7,10-11H2,1-3H3/b20-15+