5-[(Z)-4-methylpent-2-en-2-yl]thianthren-5-ium perchlorate

Systemtic Name: 5-[(Z)-4-methylpent-2-en-2-yl]thianthren-5-ium perchlorate Openeye Name: 5-[(Z)-1,3-dimethylbut-1-enyl]thianthren-5-ium perchlorate CAS Name: 5-[(Z)-4-methylpent-2-en-2-yl]thianthren-5-ium perchlorate IUPAC Name: 5-[(Z)-4-methylpent-2-en-2-yl]thianthren-5-ium perchlorate Traditional Name: 5-[(Z)-1,3-dimethylbut-1-enyl]thianthren-5-ium perchlorate Formula: C18H19ClO4S2 MolecularWeight: 398.92406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19S2.ClHO4/c1-13(2)12-14(3)20-17-10-6-4-8-15(17)19-16-9-5-7-11-18(16)20;2-1(3,4)5/h4-13H,1-3H3;(H,2,3,4,5)/q+1;/p-1/b14-12-;