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

Systemtic Name: dimethyl 5-(1,3-benzodioxol-5-ylcarbonylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 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 dimethyl ester IUPAC Name: dimethyl 5-(1,3-benzodioxole-5-carbonylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(piperonyloylamino)thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H15NO7S MolecularWeight: 377.3685

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H15NO7S/c1-8-12(16(20)22-2)15(26-13(8)17(21)23-3)18-14(19)9-4-5-10-11(6-9)25-7-24-10/h4-6H,7H2,1-3H3,(H,18,19)