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

Systemtic Name: 2-[(2S)-1-methyl-4-(quinolin-2-ylmethyl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-methyl-4-(2-quinolylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-methyl-4-(2-quinolinylmethyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-methyl-4-(quinolin-2-ylmethyl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-methyl-4-(2-quinolylmethyl)piperazin-1-ium-2-yl]ethanol Formula: C17H24N3O+ MolecularWeight: 286.39196

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1CCO)CC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

C[NH+]1CCN(C[C@@H]1CCO)CC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C17H23N3O/c1-19-9-10-20(13-16(19)8-11-21)12-15-7-6-14-4-2-3-5-17(14)18-15/h2-7,16,21H,8-13H2,1H3/p+1/t16-/m0/s1