9-(4-iodanylbutyl)thioxanthen-10-ium perchlorate

Systemtic Name: 9-(4-iodanylbutyl)thioxanthen-10-ium perchlorate Openeye Name: 9-(4-iodobutyl)thioxanthen-10-ium perchlorate CAS Name: 9-(4-iodobutyl)thioxanthen-10-ium perchlorate IUPAC Name: 9-(4-iodobutyl)thioxanthen-10-ium perchlorate Traditional Name: 9-(4-iodobutyl)thioxanthen-10-ium perchlorate Formula: C17H16ClIO4S MolecularWeight: 478.72901

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[S+]2)CCCCI.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C=CC=CC3=[S+]2)CCCCI.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C17H16IS.ClHO4/c18-12-6-5-7-13-14-8-1-3-10-16(14)19-17-11-4-2-9-15(13)17;2-1(3,4)5/h1-4,8-11H,5-7,12H2;(H,2,3,4,5)/q+1;/p-1