[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2-(4-ethanoyl-2-methoxy-phenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2-(4-ethanoyl-2-methoxy-phenoxy)ethanoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2-(4-acetyl-2-methoxy-phenoxy)acetate CAS Name: 2-(4-acetyl-2-methoxyphenoxy)acetic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2-(4-acetyl-2-methoxyphenoxy)acetate Traditional Name: 2-(4-acetyl-2-methoxy-phenoxy)acetic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(=O)OCC(=O)NCCSC2=CC=CC=C2)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OCC(=O)OCC(=O)NCCSC2=CC=CC=C2)OC

InChI

InChI=1S/C21H23NO6S/c1-15(23)16-8-9-18(19(12-16)26-2)27-14-21(25)28-13-20(24)22-10-11-29-17-6-4-3-5-7-17/h3-9,12H,10-11,13-14H2,1-2H3,(H,22,24)