[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate CAS Name: 2,3-dihydro-1,4-dioxin-5-carboxylic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate Traditional Name: 2,3-dihydro-p-dioxin-5-carboxylic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C16H19NO5S MolecularWeight: 337.39076

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(=CO1)C(=O)OCC(=O)NCCCSC2=CC=CC=C2

Isomeric SMILES

C1COC(=CO1)C(=O)OCC(=O)NCCCSC2=CC=CC=C2

InChI

InChI=1S/C16H19NO5S/c18-15(12-22-16(19)14-11-20-8-9-21-14)17-7-4-10-23-13-5-2-1-3-6-13/h1-3,5-6,11H,4,7-10,12H2,(H,17,18)