1-(6-hexylnaphthalen-2-yl)thiolan-1-ium

Systemtic Name: 1-(6-hexylnaphthalen-2-yl)thiolan-1-ium Openeye Name: 1-(6-hexyl-2-naphthyl)tetrahydrothiophen-1-ium CAS Name: 1-(6-hexyl-2-naphthalenyl)thiolan-1-ium IUPAC Name: 1-(6-hexylnaphthalen-2-yl)thiolan-1-ium Traditional Name: 1-(6-hexyl-2-naphthyl)tetrahydrothiophen-1-ium Formula: C20H27S+ MolecularWeight: 299.49338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C(C=C1)C=C(C=C2)[S+]3CCCC3

Isomeric SMILES

CCCCCCC1=CC2=C(C=C1)C=C(C=C2)[S+]3CCCC3

InChI

InChI=1S/C20H27S/c1-2-3-4-5-8-17-9-10-19-16-20(12-11-18(19)15-17)21-13-6-7-14-21/h9-12,15-16H,2-8,13-14H2,1H3/q+1