diethyl 5-[2-(4-chloranyl-3-methyl-phenoxy)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[2-(4-chloranyl-3-methyl-phenoxy)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[2-(4-chloro-3-methyl-phenoxy)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(4-chloro-3-methylphenoxy)-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[2-(4-chloro-3-methylphenoxy)propanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[2-(4-chloro-3-methyl-phenoxy)propanoylamino]-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)OC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

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

InChI

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