1-methyl-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]pyridin-1-ium-2-carboxamide iodide

Systemtic Name: 1-methyl-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]pyridin-1-ium-2-carboxamide iodide Openeye Name: 1-methyl-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]pyridin-1-ium-2-carboxamide iodide CAS Name: 1-methyl-N-[(2-methyl-4-tetradecoxyphenyl)methyl]-2-pyridin-1-iumcarboxamide iodide IUPAC Name: 1-methyl-N-[(2-methyl-4-tetradecoxyphenyl)methyl]pyridin-1-ium-2-carboxamide iodide Traditional Name: 1-methyl-N-(2-methyl-4-myristyloxy-benzyl)pyridin-1-ium-2-carboxamide iodide Formula: C29H45IN2O2 MolecularWeight: 580.58427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)CNC(=O)C2=CC=CC=[N+]2C)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)CNC(=O)C2=CC=CC=[N+]2C)C.[I-]

InChI

InChI=1S/C29H44N2O2.HI/c1-4-5-6-7-8-9-10-11-12-13-14-17-22-33-27-20-19-26(25(2)23-27)24-30-29(32)28-18-15-16-21-31(28)3;/h15-16,18-21,23H,4-14,17,22,24H2,1-3H3;1H