3-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzonitrile fumarate (1:1)
[CAS# 38791-51-4]

Identification

• Name: 3-(2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzonitrile fumarate (1:1)
• Synonyms: But-2-Enedioic Acid; 3-[2-Hydroxy-3-(Isopropylamino)Propoxy]Benzonitrile; 3-(2-Hydroxy-3-((1-Methylethyl)Amino)Propoxy)Benzonitrile Fumarate (1:1); Benzonitrile, 3-(2-Hydroxy-3-((1-Methylethyl)Amino)Propoxy)-, (Z)-2-Butenedioate (1:1)
• Molecular Formula: C₁₇H₂₂N₂O₆
• Molecular Weight: 350.37
• CAS Registry Number: 38791-51-4
• SMILES: C1=C(OCC(O)CNC(C)C)C=CC=C1C#N.O=C(O)\C=C/C(=O)O
• InChI: 1S/C13H18N2O2.C4H4O4/c1-10(2)15-8-12(16)9-17-13-5-3-4-11(6-13)7-14;5-3(6)1-2-4(7)8/h3-6,10,12,15-16H,8-9H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
• InChIKey: USGXRKFZDDKONB-BTJKTKAUSA-N