methyl 5-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoylamino]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoylamino]-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]benzothiophene-2-carboxylate CAS Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxoethyl]amino]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]-1-benzothiophene-2-carboxylate Traditional Name: 5-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]benzothiophene-2-carboxylic acid methyl ester Formula: C20H17NO5S MolecularWeight: 383.41768

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)CC3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC(=O)C1=CC2=C(S1)C=CC(=C2)NC(=O)CC3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H17NO5S/c1-24-20(23)18-11-13-10-14(3-5-17(13)27-18)21-19(22)9-12-2-4-15-16(8-12)26-7-6-25-15/h2-5,8,10-11H,6-7,9H2,1H3,(H,21,22)