(2S)-1-[(R)-(4-methylphenyl)sulfinyl]-2-oxidanyl-tridecan-7-one

Systemtic Name: (2S)-1-[(R)-(4-methylphenyl)sulfinyl]-2-oxidanyl-tridecan-7-one Openeye Name: (2S)-2-hydroxy-1-[(R)-p-tolylsulfinyl]tridecan-7-one CAS Name: (2S)-2-hydroxy-1-[(R)-(4-methylphenyl)sulfinyl]-7-tridecanone IUPAC Name: (2S)-2-hydroxy-1-[(R)-(4-methylphenyl)sulfinyl]tridecan-7-one Traditional Name: (2S)-2-hydroxy-1-[(R)-p-tolylsulfinyl]tridecan-7-one Formula: C20H32O3S MolecularWeight: 352.53128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)CCCCC(CS(=O)C1=CC=C(C=C1)C)O

Isomeric SMILES

CCCCCCC(=O)CCCC[C@@H](C[S@@](=O)C1=CC=C(C=C1)C)O

InChI

InChI=1S/C20H32O3S/c1-3-4-5-6-9-18(21)10-7-8-11-19(22)16-24(23)20-14-12-17(2)13-15-20/h12-15,19,22H,3-11,16H2,1-2H3/t19-,24+/m0/s1