methyl 3-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethoxy]benzoate

Systemtic Name: methyl 3-[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethoxy]benzoate Openeye Name: methyl 3-[2-oxo-2-(2-phenylsulfanylethylamino)ethoxy]benzoate CAS Name: 3-[2-oxo-2-[2-(phenylthio)ethylamino]ethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-oxo-2-(2-phenylsulfanylethylamino)ethoxy]benzoate Traditional Name: 3-[2-keto-2-[2-(phenylthio)ethylamino]ethoxy]benzoic acid methyl ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)OCC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)OCC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C18H19NO4S/c1-22-18(21)14-6-5-7-15(12-14)23-13-17(20)19-10-11-24-16-8-3-2-4-9-16/h2-9,12H,10-11,13H2,1H3,(H,19,20)