octanoate; triphenylsulfanium

Systemtic Name: octanoate; triphenylsulfanium Openeye Name: octanoate; triphenylsulfonium CAS Name: octanoate; triphenylsulfonium IUPAC Name: octanoate; triphenylsulfanium Traditional Name: caprylate; triphenylsulfonium Formula: C26H30O2S MolecularWeight: 406.5802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)[O-].C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCC(=O)[O-].C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H15S.C8H16O2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-2-3-4-5-6-7-8(9)10/h1-15H;2-7H2,1H3,(H,9,10)/q+1;/p-1