ethyl 4-[2-[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxyethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxyethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[4-(5-methyl-2-thienyl)-4-oxo-butanoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[4-(5-methyl-2-thiophenyl)-1,4-dioxobutoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-(5-methylthiophen-2-yl)-4-oxobutanoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[4-keto-4-(5-methyl-2-thienyl)butanoyl]oxyacetyl]amino]benzoic acid ethyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCC(=O)C2=CC=C(S2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)CCC(=O)C2=CC=C(S2)C

InChI

InChI=1S/C20H21NO6S/c1-3-26-20(25)14-5-7-15(8-6-14)21-18(23)12-27-19(24)11-9-16(22)17-10-4-13(2)28-17/h4-8,10H,3,9,11-12H2,1-2H3,(H,21,23)