O2-tert-butyl O4-ethyl 5-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 5-[2-(4-chloranyl-2-methyl-phenoxy)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 5-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-(4-chloro-2-methylphenoxy)-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 5-[2-(4-chloro-2-methylphenoxy)propanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[2-(4-chloro-2-methyl-phenoxy)propanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C23H28ClNO6S MolecularWeight: 481.98952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28ClNO6S/c1-8-29-21(27)17-13(3)18(22(28)31-23(5,6)7)32-20(17)25-19(26)14(4)30-16-10-9-15(24)11-12(16)2/h9-11,14H,8H2,1-7H3,(H,25,26)