(3S,4S)-3-(1,3-benzodioxol-5-ylmethyl)-4-(phenylsulfanylmethyl)oxolan-2-one

Systemtic Name: (3S,4S)-3-(1,3-benzodioxol-5-ylmethyl)-4-(phenylsulfanylmethyl)oxolan-2-one Openeye Name: (3S,4S)-3-(1,3-benzodioxol-5-ylmethyl)-4-(phenylsulfanylmethyl)tetrahydrofuran-2-one CAS Name: (3S,4S)-3-(1,3-benzodioxol-5-ylmethyl)-4-[(phenylthio)methyl]-2-oxolanone IUPAC Name: (3S,4S)-3-(1,3-benzodioxol-5-ylmethyl)-4-(phenylsulfanylmethyl)oxolan-2-one Traditional Name: (3S,4S)-4-[(phenylthio)methyl]-3-piperonyl-tetrahydrofuran-2-one Formula: C19H18O4S MolecularWeight: 342.40882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C(=O)O1)CC2=CC3=C(C=C2)OCO3)CSC4=CC=CC=C4

Isomeric SMILES

C1[C@H]([C@@H](C(=O)O1)CC2=CC3=C(C=C2)OCO3)CSC4=CC=CC=C4

InChI

InChI=1S/C19H18O4S/c20-19-16(8-13-6-7-17-18(9-13)23-12-22-17)14(10-21-19)11-24-15-4-2-1-3-5-15/h1-7,9,14,16H,8,10-12H2/t14-,16-/m0/s1