2-[(2S)-4-[(2,8-dimethylquinolin-4-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(2,8-dimethylquinolin-4-yl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(2,8-dimethyl-4-quinolyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(2,8-dimethyl-4-quinolinyl)methyl]-1-methyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(2,8-dimethylquinolin-4-yl)methyl]-1-methylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(2,8-dimethyl-4-quinolyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Formula: C19H28N3O+ MolecularWeight: 314.44512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2CN3CC[NH+](C(C3)CCO)C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2CN3CC[NH+]([C@H](C3)CCO)C)C

InChI

InChI=1S/C19H27N3O/c1-14-5-4-6-18-16(11-15(2)20-19(14)18)12-22-9-8-21(3)17(13-22)7-10-23/h4-6,11,17,23H,7-10,12-13H2,1-3H3/p+1/t17-/m0/s1