ethyl 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]benzofuran-2-carboxylate CAS Name: 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-1-benzofuran-2-carboxylate Traditional Name: 3-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]amino]coumarilic acid ethyl ester Formula: C21H19NO6S MolecularWeight: 413.44366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CSC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)CSC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C21H19NO6S/c1-2-25-21(24)20-19(14-5-3-4-6-15(14)28-20)22-18(23)12-29-13-7-8-16-17(11-13)27-10-9-26-16/h3-8,11H,2,9-10,12H2,1H3,(H,22,23)