N-[(4R,8S,11S)-8,11-bis(oxidanyl)pentadecan-4-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(4R,8S,11S)-8,11-bis(oxidanyl)pentadecan-4-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1R,5S,8S)-5,8-dihydroxy-1-propyl-dodecyl]-4-methyl-benzenesulfonamide CAS Name: N-[(4R,8S,11S)-8,11-dihydroxypentadecan-4-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[(4R,8S,11S)-8,11-dihydroxypentadecan-4-yl]-4-methylbenzenesulfonamide Traditional Name: N-[(1R,5S,8S)-5,8-dihydroxy-1-propyl-dodecyl]-4-methyl-benzenesulfonamide Formula: C22H39NO4S MolecularWeight: 413.61436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC(CCCC(CCC)NS(=O)(=O)C1=CC=C(C=C1)C)O)O

Isomeric SMILES

CCCC[C@@H](CC[C@H](CCC[C@@H](CCC)NS(=O)(=O)C1=CC=C(C=C1)C)O)O

InChI

InChI=1S/C22H39NO4S/c1-4-6-10-20(24)14-15-21(25)11-7-9-19(8-5-2)23-28(26,27)22-16-12-18(3)13-17-22/h12-13,16-17,19-21,23-25H,4-11,14-15H2,1-3H3/t19-,20+,21+/m1/s1