methyl 4-[2-(3-methoxy-3-oxidanylidene-propyl)sulfanylethanoylamino]benzoate

Systemtic Name: methyl 4-[2-(3-methoxy-3-oxidanylidene-propyl)sulfanylethanoylamino]benzoate Openeye Name: methyl 4-[[2-(3-methoxy-3-oxo-propyl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(3-methoxy-3-oxopropyl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(3-methoxy-3-oxopropyl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(3-keto-3-methoxy-propyl)thio]acetyl]amino]benzoic acid methyl ester Formula: C14H17NO5S MolecularWeight: 311.35348

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC(=O)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

COC(=O)CCSCC(=O)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C14H17NO5S/c1-19-13(17)7-8-21-9-12(16)15-11-5-3-10(4-6-11)14(18)20-2/h3-6H,7-9H2,1-2H3,(H,15,16)