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

Systemtic Name: methyl 4-[2-[4-(5-methylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxyethanoylamino]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C19H19NO6S MolecularWeight: 389.42226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)OCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H19NO6S/c1-12-3-9-16(27-12)15(21)8-10-18(23)26-11-17(22)20-14-6-4-13(5-7-14)19(24)25-2/h3-7,9H,8,10-11H2,1-2H3,(H,20,22)