ethyl 5-(1,3-benzodioxol-5-ylcarbonylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-(1,3-benzodioxol-5-ylcarbonylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-(1,3-benzodioxole-5-carbonylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(1,3-benzodioxole-5-carbonylamino)-3-methylthiophene-2-carboxylate Traditional Name: 3-methyl-5-(piperonyloylamino)thiophene-2-carboxylic acid ethyl ester Formula: C16H15NO5S MolecularWeight: 333.359

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C16H15NO5S/c1-3-20-16(19)14-9(2)6-13(23-14)17-15(18)10-4-5-11-12(7-10)22-8-21-11/h4-7H,3,8H2,1-2H3,(H,17,18)