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(2S)-1-(4-butoxyphenyl)-2-phenyl-3-piperidin-1-ium-1-yl-propan-1-one
(2S)-1-(4-butoxyphenyl)-2-phenyl-3-piperidin-1-ium-1-yl-propan-1-one
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Descriptors Computed from Structure
Canonical SMILES:
CCCCOC1=CC=C(C=C1)C(=O)C(C[NH+]2CCCCC2)C3=CC=CC=C3
Isomeric SMILES
CCCCOC1=CC=C(C=C1)C(=O)[C@H](C[NH+]2CCCCC2)C3=CC=CC=C3
InChI
InChI=1S/C24H31NO2/c1-2-3-18-27-22-14-12-21(13-15-22)24(26)23(20-10-6-4-7-11-20)19-25-16-8-5-9-17-25/h4,6-7,10-15,23H,2-3,5,8-9,16-19H2,1H3/p+1/t23-/m1/s1
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