[1-ethoxy-3-[3-(3-methylsulfanylpropanoylamino)phenoxy]propan-2-yl] phenyl carbonate

Systemtic Name: [1-ethoxy-3-[3-(3-methylsulfanylpropanoylamino)phenoxy]propan-2-yl] phenyl carbonate Openeye Name: [1-(ethoxymethyl)-2-[3-(3-methylsulfanylpropanoylamino)phenoxy]ethyl] phenyl carbonate CAS Name: carbonic acid [1-ethoxy-3-[3-[[3-(methylthio)-1-oxopropyl]amino]phenoxy]propan-2-yl] phenyl ester IUPAC Name: [1-ethoxy-3-[3-(3-methylsulfanylpropanoylamino)phenoxy]propan-2-yl] phenyl carbonate Traditional Name: carbonic acid [1-(ethoxymethyl)-2-[3-[3-(methylthio)propanoylamino]phenoxy]ethyl] phenyl ester Formula: C22H27NO6S MolecularWeight: 433.51788

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(COC1=CC=CC(=C1)NC(=O)CCSC)OC(=O)OC2=CC=CC=C2

Isomeric SMILES

CCOCC(COC1=CC=CC(=C1)NC(=O)CCSC)OC(=O)OC2=CC=CC=C2

InChI

InChI=1S/C22H27NO6S/c1-3-26-15-20(29-22(25)28-18-9-5-4-6-10-18)16-27-19-11-7-8-17(14-19)23-21(24)12-13-30-2/h4-11,14,20H,3,12-13,15-16H2,1-2H3,(H,23,24)