2-(9-phenylnonoxy)-1-sulfanyl-pentadecan-1-ol

Systemtic Name: 2-(9-phenylnonoxy)-1-sulfanyl-pentadecan-1-ol Openeye Name: 2-(9-phenylnonoxy)-1-sulfanyl-pentadecan-1-ol CAS Name: 1-mercapto-2-(9-phenylnonoxy)-1-pentadecanol IUPAC Name: 2-(9-phenylnonoxy)-1-sulfanylpentadecan-1-ol Traditional Name: 1-mercapto-2-(9-phenylnonoxy)pentadecan-1-ol Formula: C30H54O2S MolecularWeight: 478.81356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C(O)S)OCCCCCCCCCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCC(C(O)S)OCCCCCCCCCC1=CC=CC=C1

InChI

InChI=1S/C30H54O2S/c1-2-3-4-5-6-7-8-9-12-15-21-26-29(30(31)33)32-27-22-16-13-10-11-14-18-23-28-24-19-17-20-25-28/h17,19-20,24-25,29-31,33H,2-16,18,21-23,26-27H2,1H3