2-[(2S)-1-methyl-4-[(2-methylquinolin-4-yl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-methyl-4-[(2-methylquinolin-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-methyl-4-[(2-methyl-4-quinolyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-methyl-4-[(2-methyl-4-quinolinyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-methyl-4-[(2-methylquinolin-4-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-methyl-4-[(2-methyl-4-quinolyl)methyl]piperazin-1-ium-2-yl]ethanol Formula: C18H26N3O+ MolecularWeight: 300.41854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)CN3CC[NH+](C(C3)CCO)C

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)CN3CC[NH+]([C@H](C3)CCO)C

InChI

InChI=1S/C18H25N3O/c1-14-11-15(17-5-3-4-6-18(17)19-14)12-21-9-8-20(2)16(13-21)7-10-22/h3-6,11,16,22H,7-10,12-13H2,1-2H3/p+1/t16-/m0/s1