1-methyl-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]-N-phenyl-pyridin-1-ium-4-carboxamide iodide

Systemtic Name: 1-methyl-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]-N-phenyl-pyridin-1-ium-4-carboxamide iodide Openeye Name: 1-methyl-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]-N-phenyl-pyridin-1-ium-4-carboxamide iodide CAS Name: 1-methyl-N-[(2-methyl-3-tetradecoxyphenyl)methyl]-N-phenyl-4-pyridin-1-iumcarboxamide iodide IUPAC Name: 1-methyl-N-[(2-methyl-3-tetradecoxyphenyl)methyl]-N-phenylpyridin-1-ium-4-carboxamide iodide Traditional Name: 1-methyl-N-(2-methyl-3-myristyloxy-benzyl)-N-phenyl-pyridin-1-ium-4-carboxamide iodide Formula: C35H49IN2O2 MolecularWeight: 656.68023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1C)CN(C2=CC=CC=C2)C(=O)C3=CC=[N+](C=C3)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1C)CN(C2=CC=CC=C2)C(=O)C3=CC=[N+](C=C3)C.[I-]

InChI

InChI=1S/C35H49N2O2.HI/c1-4-5-6-7-8-9-10-11-12-13-14-18-28-39-34-23-19-20-32(30(34)2)29-37(33-21-16-15-17-22-33)35(38)31-24-26-36(3)27-25-31;/h15-17,19-27H,4-14,18,28-29H2,1-3H3;1H/q+1;/p-1