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

Systemtic Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(3-methoxy-2-tetradecoxy-phenyl)methyl]ethanamide iodide Openeye Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(3-methoxy-2-tetradecoxy-phenyl)methyl]acetamide iodide CAS Name: N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-N-[(3-methoxy-2-tetradecoxyphenyl)methyl]acetamide iodide IUPAC Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(3-methoxy-2-tetradecoxyphenyl)methyl]acetamide iodide Traditional Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(3-methoxy-2-myristyloxy-benzyl)acetamide iodide Formula: C32H51IN2O3 MolecularWeight: 638.66341

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC=C1OC)CN(CC2=CC=CC=[N+]2CC)C(=O)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC=C1OC)CN(CC2=CC=CC=[N+]2CC)C(=O)C.[I-]

InChI

InChI=1S/C32H51N2O3.HI/c1-5-7-8-9-10-11-12-13-14-15-16-19-25-37-32-29(21-20-23-31(32)36-4)26-34(28(3)35)27-30-22-17-18-24-33(30)6-2;/h17-18,20-24H,5-16,19,25-27H2,1-4H3;1H/q+1;/p-1