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2-[(2S)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]-1-(2-methylpropyl)piperazin-1-ium-2-yl]ethanol
2-[(2S)-4-[(4-methoxy-2,3-dimethyl-phenyl)methyl]-1-(2-methylpropyl)piperazin-1-ium-2-yl]ethanol
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C=CC(=C1C)OC)CN2CC[NH+](C(C2)CCO)CC(C)C
Isomeric SMILES
CC1=C(C=CC(=C1C)OC)CN2CC[NH+]([C@H](C2)CCO)CC(C)C
InChI
InChI=1S/C20H34N2O2/c1-15(2)12-22-10-9-21(14-19(22)8-11-23)13-18-6-7-20(24-5)17(4)16(18)3/h6-7,15,19,23H,8-14H2,1-5H3/p+1/t19-/m0/s1
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