[4-[2-(propanoylamino)ethylsulfanyl]-3-propanoyloxy-phenyl] propanoate

Systemtic Name: [4-[2-(propanoylamino)ethylsulfanyl]-3-propanoyloxy-phenyl] propanoate Openeye Name: [4-[2-(propanoylamino)ethylsulfanyl]-3-propanoyloxy-phenyl] propanoate CAS Name: propanoic acid [3-(1-oxopropoxy)-4-[2-(1-oxopropylamino)ethylthio]phenyl] ester IUPAC Name: [4-[2-(propanoylamino)ethylsulfanyl]-3-propanoyloxyphenyl] propanoate Traditional Name: propionic acid [4-(2-propionamidoethylthio)-3-propionyloxy-phenyl] ester Formula: C17H23NO5S MolecularWeight: 353.43322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCCSC1=C(C=C(C=C1)OC(=O)CC)OC(=O)CC

Isomeric SMILES

CCC(=O)NCCSC1=C(C=C(C=C1)OC(=O)CC)OC(=O)CC

InChI

InChI=1S/C17H23NO5S/c1-4-15(19)18-9-10-24-14-8-7-12(22-16(20)5-2)11-13(14)23-17(21)6-3/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,19)