4-(thiolan-1-ium-1-yl)naphthalen-1-ol; 4,7,7-trimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-2-sulfonate

Systemtic Name: 4-(thiolan-1-ium-1-yl)naphthalen-1-ol; 4,7,7-trimethyl-3-oxidanylidene-bicyclo[2.2.1]heptane-2-sulfonate Openeye Name: 4-tetrahydrothiophen-1-ium-1-ylnaphthalen-1-ol; 4,7,7-trimethyl-3-oxo-norbornane-2-sulfonate CAS Name: 4-(1-thiolan-1-iumyl)-1-naphthalenol; 4,7,7-trimethyl-3-oxo-2-bicyclo[2.2.1]heptanesulfonate IUPAC Name: 4-(thiolan-1-ium-1-yl)naphthalen-1-ol; 4,7,7-trimethyl-3-oxobicyclo[2.2.1]heptane-2-sulfonate Traditional Name: 3-keto-4,7,7-trimethyl-norbornane-2-sulfonate; 4-tetrahydrothiophen-1-ium-1-yl-1-naphthol Formula: C24H30O5S2 MolecularWeight: 462.622

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2S(=O)(=O)[O-])C)C.C1CC[S+](C1)C2=CC=C(C3=CC=CC=C32)O

Isomeric SMILES

CC1(C2CCC1(C(=O)C2S(=O)(=O)[O-])C)C.C1CC[S+](C1)C2=CC=C(C3=CC=CC=C32)O

InChI

InChI=1S/C14H14OS.C10H16O4S/c15-13-7-8-14(16-9-3-4-10-16)12-6-2-1-5-11(12)13;1-9(2)6-4-5-10(9,3)8(11)7(6)15(12,13)14/h1-2,5-8H,3-4,9-10H2;6-7H,4-5H2,1-3H3,(H,12,13,14)