3,3-bis(oxidanyl)-4-phenyl-hexadecanethial

Systemtic Name: 3,3-bis(oxidanyl)-4-phenyl-hexadecanethial Openeye Name: 3,3-dihydroxy-4-phenyl-hexadecanethial CAS Name: 3,3-dihydroxy-4-phenylhexadecanethial IUPAC Name: 3,3-dihydroxy-4-phenylhexadecanethial Traditional Name: 3,3-dihydroxy-4-phenyl-thiopalmitaldehyde Formula: C22H36O2S MolecularWeight: 364.58504

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1=CC=CC=C1)C(CC=S)(O)O

Isomeric SMILES

CCCCCCCCCCCCC(C1=CC=CC=C1)C(CC=S)(O)O

InChI

InChI=1S/C22H36O2S/c1-2-3-4-5-6-7-8-9-10-14-17-21(22(23,24)18-19-25)20-15-12-11-13-16-20/h11-13,15-16,19,21,23-24H,2-10,14,17-18H2,1H3