N-[(1-methylpyridin-1-ium-4-yl)methyl]-N-(2-methyl-4-tetradecoxy-phenyl)ethanamide iodide

Systemtic Name: N-[(1-methylpyridin-1-ium-4-yl)methyl]-N-(2-methyl-4-tetradecoxy-phenyl)ethanamide iodide Openeye Name: N-[(1-methylpyridin-1-ium-4-yl)methyl]-N-(2-methyl-4-tetradecoxy-phenyl)acetamide iodide CAS Name: N-[(1-methyl-4-pyridin-1-iumyl)methyl]-N-(2-methyl-4-tetradecoxyphenyl)acetamide iodide IUPAC Name: N-[(1-methylpyridin-1-ium-4-yl)methyl]-N-(2-methyl-4-tetradecoxyphenyl)acetamide iodide Traditional Name: N-(2-methyl-4-myristyloxy-phenyl)-N-[(1-methylpyridin-1-ium-4-yl)methyl]acetamide iodide Formula: C30H47IN2O2 MolecularWeight: 594.61085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)N(CC2=CC=[N+](C=C2)C)C(=O)C)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)N(CC2=CC=[N+](C=C2)C)C(=O)C)C.[I-]

InChI

InChI=1S/C30H47N2O2.HI/c1-5-6-7-8-9-10-11-12-13-14-15-16-23-34-29-17-18-30(26(2)24-29)32(27(3)33)25-28-19-21-31(4)22-20-28;/h17-22,24H,5-16,23,25H2,1-4H3;1H/q+1;/p-1