N-[2-[(3,5-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(3-fluoranyl-2-tetradecoxy-phenyl)ethanamide

Systemtic Name: N-[2-[(3,5-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(3-fluoranyl-2-tetradecoxy-phenyl)ethanamide Openeye Name: N-[2-[(3,5-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(3-fluoro-2-tetradecoxy-phenyl)acetamide CAS Name: N-[2-[(3,5-dimethyl-1-pyridin-1-iumyl)methyl]phenyl]-2-(3-fluoro-2-tetradecoxyphenyl)acetamide IUPAC Name: N-[2-[(3,5-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(3-fluoro-2-tetradecoxyphenyl)acetamide Traditional Name: N-[2-[(3,5-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(3-fluoro-2-myristyloxy-phenyl)acetamide Formula: C36H50FN2O2+ MolecularWeight: 561.792803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC=C1F)CC(=O)NC2=CC=CC=C2C[N+]3=CC(=CC(=C3)C)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1F)CC(=O)NC2=CC=CC=C2C[N+]3=CC(=CC(=C3)C)C

InChI

InChI=1S/C36H49FN2O2/c1-4-5-6-7-8-9-10-11-12-13-14-17-23-41-36-31(20-18-21-33(36)37)25-35(40)38-34-22-16-15-19-32(34)28-39-26-29(2)24-30(3)27-39/h15-16,18-22,24,26-27H,4-14,17,23,25,28H2,1-3H3/p+1