(2S,3R)-5-oxidanylidene-2-pentyl-4-(phenylsulfanylmethyl)oxolane-3-carbaldehyde

Systemtic Name: (2S,3R)-5-oxidanylidene-2-pentyl-4-(phenylsulfanylmethyl)oxolane-3-carbaldehyde Openeye Name: (2S,3R)-5-oxo-2-pentyl-4-(phenylsulfanylmethyl)tetrahydrofuran-3-carbaldehyde CAS Name: (2S,3R)-5-oxo-2-pentyl-4-[(phenylthio)methyl]-3-oxolanecarboxaldehyde IUPAC Name: (2S,3R)-5-oxo-2-pentyl-4-(phenylsulfanylmethyl)oxolane-3-carbaldehyde Traditional Name: (2S,3R)-2-amyl-5-keto-4-[(phenylthio)methyl]tetrahydrofuran-3-carbaldehyde Formula: C17H22O3S MolecularWeight: 306.41978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(C(C(=O)O1)CSC2=CC=CC=C2)C=O

Isomeric SMILES

CCCCC[C@H]1[C@@H](C(C(=O)O1)CSC2=CC=CC=C2)C=O

InChI

InChI=1S/C17H22O3S/c1-2-3-5-10-16-14(11-18)15(17(19)20-16)12-21-13-8-6-4-7-9-13/h4,6-9,11,14-16H,2-3,5,10,12H2,1H3/t14-,15?,16+/m1/s1