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(2R,3S)-3,5-dibutyl-2-pentyl-1-(phenylmethyl)-2,3-dihydropyridin-1-ium
(2R,3S)-3,5-dibutyl-2-pentyl-1-(phenylmethyl)-2,3-dihydropyridin-1-ium
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCC1C(C=C(C=[N+]1CC2=CC=CC=C2)CCCC)CCCC
Isomeric SMILES
CCCCC[C@@H]1[C@H](C=C(C=[N+]1CC2=CC=CC=C2)CCCC)CCCC
InChI
InChI=1S/C25H40N/c1-4-7-11-18-25-24(17-9-6-3)19-23(14-8-5-2)21-26(25)20-22-15-12-10-13-16-22/h10,12-13,15-16,19,21,24-25H,4-9,11,14,17-18,20H2,1-3H3/q+1/t24-,25+/m0/s1
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