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

Systemtic Name: O4-ethyl O2-methyl 5-(3-chloranylpropanoylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-methyl 5-(3-chloropropanoylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[(3-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-(3-chloropropanoylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(3-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)CCCl

Isomeric SMILES

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

InChI

InChI=1S/C13H16ClNO5S/c1-4-20-12(17)9-7(2)10(13(18)19-3)21-11(9)15-8(16)5-6-14/h4-6H2,1-3H3,(H,15,16)