[(2Z)-2-[(4-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] thiophene-2-carboxylate

Systemtic Name: [(2Z)-2-[(4-methylphenyl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl] thiophene-2-carboxylate Openeye Name: [(2Z)-3-oxo-2-(p-tolylmethylene)benzofuran-6-yl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-6-benzofuranyl] ester IUPAC Name: [(2Z)-2-[(4-methylphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [(2Z)-3-keto-2-(4-methylbenzylidene)coumaran-6-yl] ester Formula: C21H14O4S MolecularWeight: 362.39846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CS4

InChI

InChI=1S/C21H14O4S/c1-13-4-6-14(7-5-13)11-18-20(22)16-9-8-15(12-17(16)25-18)24-21(23)19-3-2-10-26-19/h2-12H,1H3/b18-11-