methyl 4-methyl-3-[2-(4-thiophen-2-ylbutanoyloxy)ethanoylamino]benzoate

Systemtic Name: methyl 4-methyl-3-[2-(4-thiophen-2-ylbutanoyloxy)ethanoylamino]benzoate Openeye Name: methyl 4-methyl-3-[[2-[4-(2-thienyl)butanoyloxy]acetyl]amino]benzoate CAS Name: 4-methyl-3-[[1-oxo-2-(1-oxo-4-thiophen-2-ylbutoxy)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[[2-(4-thiophen-2-ylbutanoyloxy)acetyl]amino]benzoate Traditional Name: 4-methyl-3-[[2-[4-(2-thienyl)butanoyloxy]acetyl]amino]benzoic acid methyl ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CCCC2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)COC(=O)CCCC2=CC=CS2

InChI

InChI=1S/C19H21NO5S/c1-13-8-9-14(19(23)24-2)11-16(13)20-17(21)12-25-18(22)7-3-5-15-6-4-10-26-15/h4,6,8-11H,3,5,7,12H2,1-2H3,(H,20,21)