O4-ethyl O2-methyl 5-(2-chloranylpropanoylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-methyl 5-(2-chloranylpropanoylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 5-(2-chloropropanoylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[(2-chloro-1-oxopropyl)amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester IUPAC Name: 4-O-ethyl 2-O-methyl 5-(2-chloropropanoylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(2-chloropropanoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-methyl ester Formula: C13H16ClNO5S MolecularWeight: 333.78784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C(C)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC)NC(=O)C(C)Cl

InChI

InChI=1S/C13H16ClNO5S/c1-5-20-12(17)8-6(2)9(13(18)19-4)21-11(8)15-10(16)7(3)14/h7H,5H2,1-4H3,(H,15,16)