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

Systemtic Name: 2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]-3-tetradecoxy-benzamide iodide Openeye Name: 2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]-3-tetradecoxy-benzamide iodide CAS Name: 2-methoxy-N-[(1-methyl-4-pyridin-1-iumyl)methyl]-3-tetradecoxybenzamide iodide IUPAC Name: 2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]-3-tetradecoxybenzamide iodide Traditional Name: 2-methoxy-N-[(1-methylpyridin-1-ium-4-yl)methyl]-3-myristyloxy-benzamide iodide Formula: C29H45IN2O3 MolecularWeight: 596.58367

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1OC)C(=O)NCC2=CC=[N+](C=C2)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1OC)C(=O)NCC2=CC=[N+](C=C2)C.[I-]

InChI

InChI=1S/C29H44N2O3.HI/c1-4-5-6-7-8-9-10-11-12-13-14-15-23-34-27-18-16-17-26(28(27)33-3)29(32)30-24-25-19-21-31(2)22-20-25;/h16-22H,4-15,23-24H2,1-3H3;1H