Metoquizine
[CAS# 7125-67-9]

Identification

• Name: Metoquizine
• Synonyms: Metoquizine [Usan:Inn]; Metoquizinum; N-(1,6-Dimethyl-8Beta-Ergolinyl)-3,5-Dimethyl-1-Pyrazolcarboxamid
• Molecular Formula: C₂₂H₂₇N₅O
• Molecular Weight: 377.49
• CAS Registry Number: 7125-67-9
• SMILES: [C@@H]35C1=CC=CC2=C1C(=C[N]2C)C[C@H]3N(C[C@H](NC([N]4N=C(C=C4C)C)=O)C5)C
• InChI: 1S/C22H27N5O/c1-13-8-14(2)27(24-13)22(28)23-16-10-18-17-6-5-7-19-21(17)15(11-25(19)3)9-20(18)26(4)12-16/h5-8,11,16,18,20H,9-10,12H2,1-4H3,(H,23,28)/t16-,18-,20-/m1/s1
• InChIKey: WGPJQOGQDROQGQ-YVWKXTFCSA-N

Properties

• Density: 1.35g/cm³ (Cal.)