dimethyl-(4-oxidanylnaphthalen-1-yl)sulfanium; 2-dodecylbenzenesulfonate

Systemtic Name: dimethyl-(4-oxidanylnaphthalen-1-yl)sulfanium; 2-dodecylbenzenesulfonate Openeye Name: 2-dodecylbenzenesulfonate; (4-hydroxy-1-naphthyl)-dimethyl-sulfonium CAS Name: 2-dodecylbenzenesulfonate; (4-hydroxy-1-naphthalenyl)-dimethylsulfonium IUPAC Name: 2-dodecylbenzenesulfonate; (4-hydroxynaphthalen-1-yl)-dimethylsulfanium Traditional Name: (4-hydroxy-1-naphthyl)-dimethyl-sulfonium; 2-laurylbesylate Formula: C30H42O4S2 MolecularWeight: 530.78208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C[S+](C)C1=CC=C(C2=CC=CC=C21)O

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C[S+](C)C1=CC=C(C2=CC=CC=C21)O

InChI

InChI=1S/C18H30O3S.C12H12OS/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;1-14(2)12-8-7-11(13)9-5-3-4-6-10(9)12/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);3-8H,1-2H3