ethyl 4-(3,4-dimethoxyphenyl)-2-[2-(2-methylbutanoyloxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[2-(2-methylbutanoyloxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[[2-(2-methylbutanoyloxy)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-2-[[2-(2-methyl-1-oxobutoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-2-[[2-(2-methylbutanoyloxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-[[2-(2-methylbutanoyloxy)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H27NO7S MolecularWeight: 449.51728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCC(=O)NC1=C(C(=CS1)C2=CC(=C(C=C2)OC)OC)C(=O)OCC

Isomeric SMILES

CCC(C)C(=O)OCC(=O)NC1=C(C(=CS1)C2=CC(=C(C=C2)OC)OC)C(=O)OCC

InChI

InChI=1S/C22H27NO7S/c1-6-13(3)21(25)30-11-18(24)23-20-19(22(26)29-7-2)15(12-31-20)14-8-9-16(27-4)17(10-14)28-5/h8-10,12-13H,6-7,11H2,1-5H3,(H,23,24)