2-[4-(5,6-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(5,6-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(5,6-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-(5,6-dimethyl-3-phenyl-7-pyrazolo[1,5-a]pyrimidinyl)-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(5,6-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(5,6-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)piperazin-1-ium-1-yl]ethanol Formula: C20H26N5O+ MolecularWeight: 352.45334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=C(C=N2)C3=CC=CC=C3)N=C1C)N4CC[NH+](CC4)CCO

Isomeric SMILES

CC1=C(N2C(=C(C=N2)C3=CC=CC=C3)N=C1C)N4CC[NH+](CC4)CCO

InChI

InChI=1S/C20H25N5O/c1-15-16(2)22-19-18(17-6-4-3-5-7-17)14-21-25(19)20(15)24-10-8-23(9-11-24)12-13-26/h3-7,14,26H,8-13H2,1-2H3/p+1