dimethyl 5-[2-(1,3-benzodioxol-5-ylcarbonyloxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[2-(1,3-benzodioxol-5-ylcarbonyloxy)ethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[[2-(1,3-benzodioxole-5-carbonyloxy)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[1,3-benzodioxol-5-yl(oxo)methoxy]-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(1,3-benzodioxole-5-carbonyloxy)acetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[(2-piperonyloyloxyacetyl)amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H17NO9S MolecularWeight: 435.40458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)COC(=O)C2=CC3=C(C=C2)OCO3)C(=O)OC

InChI

InChI=1S/C19H17NO9S/c1-9-14(18(23)25-2)16(30-15(9)19(24)26-3)20-13(21)7-27-17(22)10-4-5-11-12(6-10)29-8-28-11/h4-6H,7-8H2,1-3H3,(H,20,21)