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

Systemtic Name: methyl 5-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]thiophene-2-carboxylate CAS Name: 5-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxopropyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]thiophene-2-carboxylate Traditional Name: 5-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)propanoylamino]thiophene-2-carboxylic acid methyl ester Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(S1)NC(=O)CCC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

COC(=O)C1=CC=C(S1)NC(=O)CCC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C17H17NO5S/c1-21-17(20)14-5-7-16(24-14)18-15(19)6-3-11-2-4-12-13(10-11)23-9-8-22-12/h2,4-5,7,10H,3,6,8-9H2,1H3,(H,18,19)