N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-(4-methoxy-3-tetradecoxy-phenoxy)ethanamide iodide

Systemtic Name: N-ethanoyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-(4-methoxy-3-tetradecoxy-phenoxy)ethanamide iodide Openeye Name: N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-(4-methoxy-3-tetradecoxy-phenoxy)acetamide iodide CAS Name: N-acetyl-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-2-(4-methoxy-3-tetradecoxyphenoxy)acetamide iodide IUPAC Name: N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-(4-methoxy-3-tetradecoxyphenoxy)acetamide iodide Traditional Name: N-acetyl-N-[(1-ethylpyridin-1-ium-2-yl)methyl]-2-(4-methoxy-3-myristyloxy-phenoxy)acetamide iodide Formula: C33H51IN2O5 MolecularWeight: 682.67291

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)OCC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=CC(=C1)OCC(=O)N(CC2=CC=CC=[N+]2CC)C(=O)C)OC.[I-]

InChI

InChI=1S/C33H51N2O5.HI/c1-5-7-8-9-10-11-12-13-14-15-16-19-24-39-32-25-30(21-22-31(32)38-4)40-27-33(37)35(28(3)36)26-29-20-17-18-23-34(29)6-2;/h17-18,20-23,25H,5-16,19,24,26-27H2,1-4H3;1H/q+1;/p-1