4-Methyl-1-(3-Oxo-3H-Naphtho[2,1-b]Pyran-2-Yl)-1H-1,2,4-Triazolium Methyl Sulphate
[CAS# 67883-54-9]

Identification

• Name: 4-Methyl-1-(3-Oxo-3H-Naphtho[2,1-b]Pyran-2-Yl)-1H-1,2,4-Triazolium Methyl Sulphate
• Synonyms: Methyl Sulfate; 2-(4-Methyl-1,2,4-Triazol-4-Ium-1-Yl)-3-Benzo[F]Chromenone; 4-Methyl-1-(3-Oxo-3H-Naphtho(2,1-B)Pyran-2-Yl)-1H-1,2,4-Triazoliummethyl Sulphate
• Molecular Formula: C₁₇H₁₅N₃O₆S
• Molecular Weight: 389.38
• CAS Registry Number: 67883-54-9
• EINECS: 267-551-9
• SMILES: CO[S]([O-])(=O)=O.C2=C1OC(=O)C(=CC1=C3C(=C2)C=CC=C3)[N+]4=C[N](C=N4)C
• InChI: 1S/C16H12N3O2.CH4O4S/c1-18-9-17-19(10-18)14-8-13-12-5-3-2-4-11(12)6-7-15(13)21-16(14)20;1-5-6(2,3)4/h2-10H,1H3;1H3,(H,2,3,4)/q+1;/p-1
• InChIKey: UOTLXUHKIABILF-UHFFFAOYSA-M