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

Systemtic Name: N-[(1-ethylpyridin-1-ium-3-yl)methyl]-2-methoxy-3-tetradecoxy-benzamide iodide Openeye Name: N-[(1-ethylpyridin-1-ium-3-yl)methyl]-2-methoxy-3-tetradecoxy-benzamide iodide CAS Name: N-[(1-ethyl-3-pyridin-1-iumyl)methyl]-2-methoxy-3-tetradecoxybenzamide iodide IUPAC Name: N-[(1-ethylpyridin-1-ium-3-yl)methyl]-2-methoxy-3-tetradecoxybenzamide iodide Traditional Name: N-[(1-ethylpyridin-1-ium-3-yl)methyl]-2-methoxy-3-myristyloxy-benzamide iodide Formula: C30H47IN2O3 MolecularWeight: 610.61025

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H46N2O3.HI/c1-4-6-7-8-9-10-11-12-13-14-15-16-23-35-28-21-17-20-27(29(28)34-3)30(33)31-24-26-19-18-22-32(5-2)25-26;/h17-22,25H,4-16,23-24H2,1-3H3;1H