2-(3-methoxy-4-tetradecoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]ethanamide iodide

Systemtic Name: 2-(3-methoxy-4-tetradecoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]ethanamide iodide Openeye Name: 2-(3-methoxy-4-tetradecoxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide iodide CAS Name: 2-(3-methoxy-4-tetradecoxyphenyl)-N-[(1-methyl-2-pyridin-1-iumyl)methyl]acetamide iodide IUPAC Name: 2-(3-methoxy-4-tetradecoxyphenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide iodide Traditional Name: 2-(3-methoxy-4-myristyloxy-phenyl)-N-[(1-methylpyridin-1-ium-2-yl)methyl]acetamide iodide Formula: C30H47IN2O3 MolecularWeight: 610.61025

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2C)OC.[I-]

InChI

InChI=1S/C30H46N2O3.HI/c1-4-5-6-7-8-9-10-11-12-13-14-17-22-35-28-20-19-26(23-29(28)34-3)24-30(33)31-25-27-18-15-16-21-32(27)2;/h15-16,18-21,23H,4-14,17,22,24-25H2,1-3H3;1H