ethyl 2-acetamido-5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-acetamido-5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-acetamido-5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiophene-3-carboxylate CAS Name: 2-acetamido-5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-acetamido-5-(1,3-benzodioxol-5-ylmethyl)-4-methylthiophene-3-carboxylate Traditional Name: 2-acetamido-4-methyl-5-piperonyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)CC2=CC3=C(C=C2)OCO3)NC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)CC2=CC3=C(C=C2)OCO3)NC(=O)C

InChI

InChI=1S/C18H19NO5S/c1-4-22-18(21)16-10(2)15(25-17(16)19-11(3)20)8-12-5-6-13-14(7-12)24-9-23-13/h5-7H,4,8-9H2,1-3H3,(H,19,20)