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2-[4-(diphenylmethyl)oxy-1-ethyl-piperidin-1-ium-1-yl]pentanoic acid
2-[4-(diphenylmethyl)oxy-1-ethyl-piperidin-1-ium-1-yl]pentanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCCC(C(=O)O)[N+]1(CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3)CC
Isomeric SMILES
CCCC(C(=O)O)[N+]1(CCC(CC1)OC(C2=CC=CC=C2)C3=CC=CC=C3)CC
InChI
InChI=1S/C25H33NO3/c1-3-11-23(25(27)28)26(4-2)18-16-22(17-19-26)29-24(20-12-7-5-8-13-20)21-14-9-6-10-15-21/h5-10,12-15,22-24H,3-4,11,16-19H2,1-2H3/p+1
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