1-(6-butoxynaphthalen-2-yl)thiolan-1-ium; methanesulfonate

Systemtic Name: 1-(6-butoxynaphthalen-2-yl)thiolan-1-ium; methanesulfonate Openeye Name: 1-(6-butoxy-2-naphthyl)tetrahydrothiophen-1-ium; methanesulfonate CAS Name: 1-(6-butoxy-2-naphthalenyl)thiolan-1-ium; methanesulfonate IUPAC Name: 1-(6-butoxynaphthalen-2-yl)thiolan-1-ium; methanesulfonate Traditional Name: 1-(6-butoxy-2-naphthyl)tetrahydrothiophen-1-ium mesylate Formula: C19H26O4S2 MolecularWeight: 382.53734

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C=C(C=C2)[S+]3CCCC3.CS(=O)(=O)[O-]

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C=C(C=C2)[S+]3CCCC3.CS(=O)(=O)[O-]

InChI

InChI=1S/C18H23OS.CH4O3S/c1-2-3-10-19-17-8-6-16-14-18(9-7-15(16)13-17)20-11-4-5-12-20;1-5(2,3)4/h6-9,13-14H,2-5,10-12H2,1H3;1H3,(H,2,3,4)/q+1;/p-1