2-[(2S)-4-[(2,5-dimethylphenyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(2,5-dimethylphenyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-4-[(2,5-dimethylphenyl)methyl]-1-methyl-piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(2,5-dimethylphenyl)methyl]-1-methyl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(2,5-dimethylphenyl)methyl]-1-methylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-(2,5-dimethylbenzyl)-1-methyl-piperazin-1-ium-2-yl]ethanol Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CC[NH+](C(C2)CCO)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2CC[NH+]([C@H](C2)CCO)C

InChI

InChI=1S/C16H26N2O/c1-13-4-5-14(2)15(10-13)11-18-8-7-17(3)16(12-18)6-9-19/h4-5,10,16,19H,6-9,11-12H2,1-3H3/p+1/t16-/m0/s1