[(1R)-1-[(3R,4R)-2-oxidanylidene-4-propylsulfanyl-azetidin-3-yl]ethyl] hex-5-ynoate

Systemtic Name: [(1R)-1-[(3R,4R)-2-oxidanylidene-4-propylsulfanyl-azetidin-3-yl]ethyl] hex-5-ynoate Openeye Name: [(1R)-1-[(3R,4R)-2-oxo-4-propylsulfanyl-azetidin-3-yl]ethyl] hex-5-ynoate CAS Name: 5-hexynoic acid [(1R)-1-[(3R,4R)-2-oxo-4-(propylthio)-3-azetidinyl]ethyl] ester IUPAC Name: [(1R)-1-[(3R,4R)-2-oxo-4-propylsulfanylazetidin-3-yl]ethyl] hex-5-ynoate Traditional Name: hex-5-ynoic acid [(1R)-1-[(3R,4R)-2-keto-4-(propylthio)azetidin-3-yl]ethyl] ester Formula: C14H21NO3S MolecularWeight: 283.38644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCSC1C(C(=O)N1)C(C)OC(=O)CCCC#C

Isomeric SMILES

CCCS[C@@H]1[C@@H](C(=O)N1)[C@@H](C)OC(=O)CCCC#C

InChI

InChI=1S/C14H21NO3S/c1-4-6-7-8-11(16)18-10(3)12-13(17)15-14(12)19-9-5-2/h1,10,12,14H,5-9H2,2-3H3,(H,15,17)/t10-,12-,14-/m1/s1