2-pentadecyl-1,3-benzoxathiol-1-ium

Systemtic Name: 2-pentadecyl-1,3-benzoxathiol-1-ium Openeye Name: 2-pentadecyl-1,3-benzoxathiol-1-ium CAS Name: 2-pentadecyl-1,3-benzoxathiol-1-ium IUPAC Name: 2-pentadecyl-1,3-benzoxathiol-1-ium Traditional Name: 2-pentadecyl-1,3-benzoxathiol-1-ium Formula: C22H35OS+ MolecularWeight: 347.5777

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=[O+]C2=CC=CC=C2S1

Isomeric SMILES

CCCCCCCCCCCCCCCC1=[O+]C2=CC=CC=C2S1

InChI

InChI=1S/C22H35OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-19-22-23-20-17-15-16-18-21(20)24-22/h15-18H,2-14,19H2,1H3/q+1