Search MNXref
 Feedback

(R)-nicotine isomethonium ion

PropertiesImage
MNX_IDMNXM19896 Image of MNXM19896
referencemetacycM:CPD-3183
formulaC11H18N2
global charge2
mol weight178.279
InChIKeyHIOROZIUERMMRQ-LLVKDONJSA-O
InChIInChI=1S/C11H17N2/c1-12-7-3-5-10(9-12)11-6-4-8-13(11)2/h3,5,7,9,11H,4,6,8H2,1-2H3/q+1/p+1/t11-/m1/s1
SMILESC[N+]1=CC=CC([C@H]2CCC[NH+]2C)=C1
MNX internals
InChI (mnx)InChI=1/C11H17N2/c1-12-7-3-5-10(9-12)11-6-4-8-13(11)2/h3,5,7,9,11H,4,6,8H2,1-2H3/q+1/t11-/m1/s1 Image of MNXM19896
SMILES (mnx)[CH3:1][N+:12]1=[CH:7][CH:3]=[CH:5][C:10]([C@H:11]2[CH2:6][CH2:4][CH2:8][N:13]2[CH3:2])=[CH:9]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-3183
metacycM:CPD-3183
HIOROZIUERMMRQ-LLVKDONJSA-O
(R)-nicotine isomethonium ion
(R)-N-methylnicotinium ion

seed.compound:cpd24395
seedM:cpd24395
HIOROZIUERMMRQ-LLVKDONJSA-O
N-methylnicotinium ion
(R)-N-methylnicotinium ion
(R)-nicotine isomethonium ion
nicotine isomethonium ion

seedM:M_cpd24395
secondary/obsolete/fantasy identifier