diethyl 5-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[[2-(4-chloranylphenoxy)-2-methyl-propanoyl]amino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(4-chlorophenoxy)-2-methyl-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[[2-(4-chlorophenoxy)-2-methylpropanoyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-chlorophenoxy)-2-methyl-propanoyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C21H24ClNO6S MolecularWeight: 453.93636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C(C)(C)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)C(C)(C)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClNO6S/c1-6-27-18(24)15-12(3)16(19(25)28-7-2)30-17(15)23-20(26)21(4,5)29-14-10-8-13(22)9-11-14/h8-11H,6-7H2,1-5H3,(H,23,26)