2-(3-methoxy-4-tetradecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-4-yl)ethyl]ethanamide iodide

Systemtic Name: 2-(3-methoxy-4-tetradecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-4-yl)ethyl]ethanamide iodide Openeye Name: 2-(3-methoxy-4-tetradecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-4-yl)ethyl]acetamide iodide CAS Name: 2-(3-methoxy-4-tetradecoxyphenoxy)-N-[2-(1-propyl-4-pyridin-1-iumyl)ethyl]acetamide iodide IUPAC Name: 2-(3-methoxy-4-tetradecoxyphenoxy)-N-[2-(1-propylpyridin-1-ium-4-yl)ethyl]acetamide iodide Traditional Name: 2-(3-methoxy-4-myristyloxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-4-yl)ethyl]acetamide iodide Formula: C33H53IN2O4 MolecularWeight: 668.68939

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)OCC(=O)NCCC2=CC=[N+](C=C2)CCC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)OCC(=O)NCCC2=CC=[N+](C=C2)CCC)OC.[I-]

InChI

InChI=1S/C33H52N2O4.HI/c1-4-6-7-8-9-10-11-12-13-14-15-16-26-38-31-18-17-30(27-32(31)37-3)39-28-33(36)34-22-19-29-20-24-35(23-5-2)25-21-29;/h17-18,20-21,24-25,27H,4-16,19,22-23,26,28H2,1-3H3;1H