methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonylamino)-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)benzothiophene-2-carboxylate CAS Name: 3-[[2,3-dihydro-1,4-benzodioxin-6-yl(oxo)methyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)-1-benzothiophene-2-carboxylate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-carbonylamino)benzothiophene-2-carboxylic acid methyl ester Formula: C19H15NO5S MolecularWeight: 369.3911

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2S1)NC(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H15NO5S/c1-23-19(22)17-16(12-4-2-3-5-15(12)26-17)20-18(21)11-6-7-13-14(10-11)25-9-8-24-13/h2-7,10H,8-9H2,1H3,(H,20,21)