5-(3-methylbut-2-en-2-yl)thianthren-5-ium perchlorate

Systemtic Name: 5-(3-methylbut-2-en-2-yl)thianthren-5-ium perchlorate Openeye Name: 5-(1,2-dimethylprop-1-enyl)thianthren-5-ium perchlorate CAS Name: 5-(3-methylbut-2-en-2-yl)thianthren-5-ium perchlorate IUPAC Name: 5-(3-methylbut-2-en-2-yl)thianthren-5-ium perchlorate Traditional Name: 5-(1,2-dimethylprop-1-enyl)thianthren-5-ium perchlorate Formula: C17H17ClO4S2 MolecularWeight: 384.89748

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)[S+]1C2=CC=CC=C2SC3=CC=CC=C31)C.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(=C(C)[S+]1C2=CC=CC=C2SC3=CC=CC=C31)C.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H17S2.ClHO4/c1-12(2)13(3)19-16-10-6-4-8-14(16)18-15-9-5-7-11-17(15)19;2-1(3,4)5/h4-11H,1-3H3;(H,2,3,4,5)/q+1;/p-1