2-[(2S)-4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-1-(1-methylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-1-(1-methylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(4-methoxy-2,5-dimethyl-phenyl)methyl]-1-(1-methyl-4-piperidyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(4-methoxy-2,5-dimethylphenyl)methyl]-1-(1-methyl-4-piperidinyl)-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(4-methoxy-2,5-dimethylphenyl)methyl]-1-(1-methylpiperidin-4-yl)piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(4-methoxy-2,5-dimethyl-benzyl)-1-(1-methyl-4-piperidyl)piperazin-1-ium-2-yl]ethanol Formula: C22H38N3O2+ MolecularWeight: 376.55602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CN2CC[NH+](C(C2)CCO)C3CCN(CC3)C)C)OC

Isomeric SMILES

CC1=CC(=C(C=C1CN2CC[NH+]([C@H](C2)CCO)C3CCN(CC3)C)C)OC

InChI

InChI=1S/C22H37N3O2/c1-17-14-22(27-4)18(2)13-19(17)15-24-10-11-25(21(16-24)7-12-26)20-5-8-23(3)9-6-20/h13-14,20-21,26H,5-12,15-16H2,1-4H3/p+1/t21-/m0/s1