Valpinax
[CAS# 78891-89-1]

Identification

• Name: Valpinax
• Synonyms: 7-Chloro-1-Methyl-5-Phenyl-3H-1,4-Benzodiazepin-2-One; 2-Propylpentanoic Acid (8,8-Dimethyl-8-Azoniabicyclo[3.2.1]Octan-3-Yl) Ester; Bromide; 7-Chloro-1-Methyl-5-Phenyl-3H-1,4-Benzodiazepin-2-One; 2-Propylvaleric Acid (8,8-Dimethyl-8-Azoniabicyclo[3.2.1]Octan-3-Yl) Ester; Bromide
• Molecular Formula: C₃₃H₄₅BrClN₃O₃
• Molecular Weight: 647.09
• CAS Registry Number: 78891-89-1
• SMILES: C1=C2C(=CC=C1Cl)N(C(=O)CN=C2C3=CC=CC=C3)C.C(C(C(OC4CC5[N+](C(C4)CC5)(C)C)=O)CCC)CC.[Br-]
• InChI: 1S/C17H32NO2.C16H13ClN2O.BrH/c1-5-7-13(8-6-2)17(19)20-16-11-14-9-10-15(12-16)18(14,3)4;1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11;/h13-16H,5-12H2,1-4H3;2-9H,10H2,1H3;1H/q+1;;/p-1
• InChIKey: GDBCBWSPLDVSGD-UHFFFAOYSA-M