Methantheline Bromide
[CAS# 53-46-3]

Identification

• Name: Methantheline Bromide
• Synonyms: Diethyl-Methyl-[2-(9H-Xanthene-9-Carbonyloxy)Ethyl]Ammonium Bromide; Diethyl-Methyl-[2-[Oxo-(9H-Xanthen-9-Yl)Methoxy]Ethyl]Ammonium Bromide; Diethyl-Methyl-[2-(9H-Xanthen-9-Ylcarbonyloxy)Ethyl]Azanium Bromide
• Molecular Formula: C₂₁H₂₆BrNO₃
• Molecular Weight: 420.35
• CAS Registry Number: 53-46-3
• EINECS: 200-176-0
• SMILES: C1=CC=CC3=C1C(C2=C(C=CC=C2)O3)C(OCC[N+](CC)(CC)C)=O.[Br-]
• InChI: 1S/C21H26NO3.BrH/c1-4-22(3,5-2)14-15-24-21(23)20-16-10-6-8-12-18(16)25-19-13-9-7-11-17(19)20;/h6-13,20H,4-5,14-15H2,1-3H3;1H/q+1;/p-1
• InChIKey: PQMWYJDJHJQZDE-UHFFFAOYSA-M