3-methyl-9-phenyl-thioxanthen-10-ium perchlorate

Systemtic Name: 3-methyl-9-phenyl-thioxanthen-10-ium perchlorate Openeye Name: 3-methyl-9-phenyl-thioxanthen-10-ium perchlorate CAS Name: 3-methyl-9-phenylthioxanthen-10-ium perchlorate IUPAC Name: 3-methyl-9-phenylthioxanthen-10-ium perchlorate Traditional Name: 3-methyl-9-phenyl-thioxanthen-10-ium perchlorate Formula: C20H15ClO4S MolecularWeight: 386.8487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=[S+]C3=CC=CC=C3C(=C2C=C1)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC2=[S+]C3=CC=CC=C3C(=C2C=C1)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H15S.ClHO4/c1-14-11-12-17-19(13-14)21-18-10-6-5-9-16(18)20(17)15-7-3-2-4-8-15;2-1(3,4)5/h2-13H,1H3;(H,2,3,4,5)/q+1;/p-1