9-(phenylmethyl)thioxanthen-10-ium perchlorate

Systemtic Name: 9-(phenylmethyl)thioxanthen-10-ium perchlorate Openeye Name: 9-benzylthioxanthen-10-ium perchlorate CAS Name: 9-(phenylmethyl)thioxanthen-10-ium perchlorate IUPAC Name: 9-benzylthioxanthen-10-ium perchlorate Traditional Name: 9-benzylthioxanthen-10-ium perchlorate Formula: C20H15ClO4S MolecularWeight: 386.8487

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C3C=CC=CC3=[S+]C4=CC=CC=C42.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C3C=CC=CC3=[S+]C4=CC=CC=C42.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C20H15S.ClHO4/c1-2-8-15(9-3-1)14-18-16-10-4-6-12-19(16)21-20-13-7-5-11-17(18)20;2-1(3,4)5/h1-13H,14H2;(H,2,3,4,5)/q+1;/p-1