13-(oxan-2-yl)tridecyl-[1-(2-propylphenyl)carbonyloxyethyl]sulfanium

Systemtic Name: 13-(oxan-2-yl)tridecyl-[1-(2-propylphenyl)carbonyloxyethyl]sulfanium Openeye Name: 1-(2-propylbenzoyl)oxyethyl-(13-tetrahydropyran-2-yltridecyl)sulfonium CAS Name: 13-(2-oxanyl)tridecyl-[1-[oxo-(2-propylphenyl)methoxy]ethyl]sulfonium IUPAC Name: 13-(oxan-2-yl)tridecyl-[1-(2-propylbenzoyl)oxyethyl]sulfanium Traditional Name: 1-(2-propylbenzoyl)oxyethyl-(13-tetrahydropyran-2-yltridecyl)sulfonium Formula: C30H51O3S+ MolecularWeight: 491.78914

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1C(=O)OC(C)[SH+]CCCCCCCCCCCCCC2CCCCO2

Isomeric SMILES

CCCC1=CC=CC=C1C(=O)OC(C)[SH+]CCCCCCCCCCCCCC2CCCCO2

InChI

InChI=1S/C30H50O3S/c1-3-19-27-20-14-15-23-29(27)30(31)33-26(2)34-25-18-12-10-8-6-4-5-7-9-11-13-21-28-22-16-17-24-32-28/h14-15,20,23,26,28H,3-13,16-19,21-22,24-25H2,1-2H3/p+1