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6-(5-fluoranyl-2,3,3-trimethyl-indol-1-ium-1-yl)hexanoic acid

6-(5-fluoranyl-2,3,3-trimethyl-indol-1-ium-1-yl)hexanoic acid

Systemtic Name:6-(5-fluoranyl-2,3,3-trimethyl-indol-1-ium-1-yl)hexanoic acid
Openeye Name:6-(5-fluoro-2,3,3-trimethyl-indol-1-ium-1-yl)hexanoic acid
CAS Name:6-(5-fluoro-2,3,3-trimethyl-1-indol-1-iumyl)hexanoic acid
IUPAC Name:6-(5-fluoro-2,3,3-trimethylindol-1-ium-1-yl)hexanoic acid
Traditional Name:6-(5-fluoro-2,3,3-trimethyl-indol-1-ium-1-yl)hexanoic acid
Formula: C17H23FNO2+
MolecularWeight: 292.368423
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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(C1(C)C)C=C(C=C2)F)CCCCCC(=O)O


Isomeric SMILES

CC1=[N+](C2=C(C1(C)C)C=C(C=C2)F)CCCCCC(=O)O


InChI

InChI=1S/C17H22FNO2/c1-12-17(2,3)14-11-13(18)8-9-15(14)19(12)10-6-4-5-7-16(20)21/h8-9,11H,4-7,10H2,1-3H3/p+1


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