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(3S)-1-(1H-imidazol-2-ylmethyl)-3-[2-(2-methylphenyl)ethyl]piperidin-1-ium
(3S)-1-(1H-imidazol-2-ylmethyl)-3-[2-(2-methylphenyl)ethyl]piperidin-1-ium
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC=CC=C1CCC2CCC[NH+](C2)CC3=NC=CN3
Isomeric SMILES
CC1=CC=CC=C1CC[C@H]2CCC[NH+](C2)CC3=NC=CN3
InChI
InChI=1S/C18H25N3/c1-15-5-2-3-7-17(15)9-8-16-6-4-12-21(13-16)14-18-19-10-11-20-18/h2-3,5,7,10-11,16H,4,6,8-9,12-14H2,1H3,(H,19,20)/p+1/t16-/m1/s1
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