3-[(4R,5R)-2,2-dimethyl-5-phenylsulfanyl-1,3-dioxolan-4-yl]propanal

Systemtic Name: 3-[(4R,5R)-2,2-dimethyl-5-phenylsulfanyl-1,3-dioxolan-4-yl]propanal Openeye Name: 3-[(4R,5R)-2,2-dimethyl-5-phenylsulfanyl-1,3-dioxolan-4-yl]propanal CAS Name: 3-[(4R,5R)-2,2-dimethyl-5-(phenylthio)-1,3-dioxolan-4-yl]propanal IUPAC Name: 3-[(4R,5R)-2,2-dimethyl-5-phenylsulfanyl-1,3-dioxolan-4-yl]propanal Traditional Name: 3-[(4R,5R)-2,2-dimethyl-5-(phenylthio)-1,3-dioxolan-4-yl]propionaldehyde Formula: C14H18O3S MolecularWeight: 266.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(C(O1)SC2=CC=CC=C2)CCC=O)C

Isomeric SMILES

CC1(O[C@@H]([C@H](O1)SC2=CC=CC=C2)CCC=O)C

InChI

InChI=1S/C14H18O3S/c1-14(2)16-12(9-6-10-15)13(17-14)18-11-7-4-3-5-8-11/h3-5,7-8,10,12-13H,6,9H2,1-2H3/t12-,13-/m1/s1