O2-tert-butyl O4-ethyl 5-(4-chloranylbutanoylamino)-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-tert-butyl O4-ethyl 5-(4-chloranylbutanoylamino)-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-tert-butyl O4-ethyl 5-(4-chlorobutanoylamino)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[(4-chloro-1-oxobutyl)amino]-3-methylthiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester IUPAC Name: 2-O-tert-butyl 4-O-ethyl 5-(4-chlorobutanoylamino)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(4-chlorobutanoylamino)-3-methyl-thiophene-2,4-dicarboxylic acid O2-tert-butyl ester O4-ethyl ester Formula: C17H24ClNO5S MolecularWeight: 389.89416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24ClNO5S/c1-6-23-15(21)12-10(2)13(16(22)24-17(3,4)5)25-14(12)19-11(20)8-7-9-18/h6-9H2,1-5H3,(H,19,20)