(3R,4S)-3-decyl-4-phenylsulfanyl-oxolane-2,5-dione

Systemtic Name: (3R,4S)-3-decyl-4-phenylsulfanyl-oxolane-2,5-dione Openeye Name: (3R,4S)-3-decyl-4-phenylsulfanyl-tetrahydrofuran-2,5-dione CAS Name: (3R,4S)-3-decyl-4-(phenylthio)oxolane-2,5-dione IUPAC Name: (3R,4S)-3-decyl-4-phenylsulfanyloxolane-2,5-dione Traditional Name: (3R,4S)-3-decyl-4-(phenylthio)tetrahydrofuran-2,5-quinone Formula: C20H28O3S MolecularWeight: 348.49952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1C(C(=O)OC1=O)SC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCC[C@H]1[C@@H](C(=O)OC1=O)SC2=CC=CC=C2

InChI

InChI=1S/C20H28O3S/c1-2-3-4-5-6-7-8-12-15-17-18(20(22)23-19(17)21)24-16-13-10-9-11-14-16/h9-11,13-14,17-18H,2-8,12,15H2,1H3/t17-,18-/m0/s1