4-methyl-3-phenyl-2H-benzo[h][1,4]benzothiazin-4-ium perchlorate

Systemtic Name: 4-methyl-3-phenyl-2H-benzo[h][1,4]benzothiazin-4-ium perchlorate Openeye Name: 4-methyl-3-phenyl-2H-benzo[h][1,4]benzothiazin-4-ium perchlorate CAS Name: 4-methyl-3-phenyl-2H-benzo[h][1,4]benzothiazin-4-ium perchlorate IUPAC Name: 4-methyl-3-phenyl-2H-benzo[h][1,4]benzothiazin-4-ium perchlorate Traditional Name: 4-methyl-3-phenyl-2H-benzo[h][1,4]benzothiazin-4-ium perchlorate Formula: C19H16ClNO4S MolecularWeight: 389.85264

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(CSC2=C1C=CC3=CC=CC=C32)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C[N+]1=C(CSC2=C1C=CC3=CC=CC=C32)C4=CC=CC=C4.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C19H16NS.ClHO4/c1-20-17-12-11-14-7-5-6-10-16(14)19(17)21-13-18(20)15-8-3-2-4-9-15;2-1(3,4)5/h2-12H,13H2,1H3;(H,2,3,4,5)/q+1;/p-1