ethyl 2-[2-[4-(3-bromanylphenoxy)butanoyloxy]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[4-(3-bromanylphenoxy)butanoyloxy]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[4-(3-bromophenoxy)butanoyloxy]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[4-(3-bromophenoxy)-1-oxobutoxy]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[4-(3-bromophenoxy)butanoyloxy]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[[2-[4-(3-bromophenoxy)butanoyloxy]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H24BrNO6S MolecularWeight: 498.38736

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)CCCOC2=CC(=CC=C2)Br

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)COC(=O)CCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C21H24BrNO6S/c1-4-27-21(26)19-13(2)14(3)30-20(19)23-17(24)12-29-18(25)9-6-10-28-16-8-5-7-15(22)11-16/h5,7-8,11H,4,6,9-10,12H2,1-3H3,(H,23,24)