diethyl 5-(1,3-benzodioxol-5-ylcarbonylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-(1,3-benzodioxol-5-ylcarbonylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-(1,3-benzodioxole-5-carbonylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(1,3-benzodioxole-5-carbonylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(piperonyloylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H19NO7S MolecularWeight: 405.42166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H19NO7S/c1-4-24-18(22)14-10(3)15(19(23)25-5-2)28-17(14)20-16(21)11-6-7-12-13(8-11)27-9-26-12/h6-8H,4-5,9H2,1-3H3,(H,20,21)