phenyl (4E)-3-methyl-4-(thiophen-2-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate

Systemtic Name: phenyl (4E)-3-methyl-4-(thiophen-2-ylcarbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Openeye Name: phenyl (4E)-3-methyl-4-(thiophene-2-carbonylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylate CAS Name: (4E)-3-methyl-4-[[oxo(thiophen-2-yl)methyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-carboxylic acid phenyl ester IUPAC Name: phenyl (4E)-3-methyl-4-(thiophene-2-carbonylhydrazinylidene)-6,7-dihydro-5H-1-benzofuran-2-carboxylate Traditional Name: (4E)-3-methyl-4-(2-thenoylhydrazono)-6,7-dihydro-5H-benzofuran-2-carboxylic acid phenyl ester Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=CS3)CCC2)C(=O)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=CS3)/CCC2)C(=O)OC4=CC=CC=C4

InChI

InChI=1S/C21H18N2O4S/c1-13-18-15(22-23-20(24)17-11-6-12-28-17)9-5-10-16(18)27-19(13)21(25)26-14-7-3-2-4-8-14/h2-4,6-8,11-12H,5,9-10H2,1H3,(H,23,24)/b22-15+