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

Systemtic Name: 2-(3-methoxy-4-tetradecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]ethanamide iodide Openeye Name: 2-(3-methoxy-4-tetradecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]acetamide iodide CAS Name: 2-(3-methoxy-4-tetradecoxyphenoxy)-N-[2-(1-propyl-3-pyridin-1-iumyl)ethyl]acetamide iodide IUPAC Name: 2-(3-methoxy-4-tetradecoxyphenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]acetamide iodide Traditional Name: 2-(3-methoxy-4-myristyloxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-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=C[N+](=CC=C2)CCC)OC.[I-]

Isomeric SMILES

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

InChI

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