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2-[(2S)-1-cyclopentyl-4-[(4-ethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol
2-[(2S)-1-cyclopentyl-4-[(4-ethoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanol
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Descriptors Computed from Structure
Canonical SMILES:
CCOC1=CC=C(C=C1)CN2CC[NH+](C(C2)CCO)C3CCCC3
Isomeric SMILES
CCOC1=CC=C(C=C1)CN2CC[NH+]([C@H](C2)CCO)C3CCCC3
InChI
InChI=1S/C20H32N2O2/c1-2-24-20-9-7-17(8-10-20)15-21-12-13-22(18-5-3-4-6-18)19(16-21)11-14-23/h7-10,18-19,23H,2-6,11-16H2,1H3/p+1/t19-/m0/s1
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