2-(4-hexadecoxy-2-methoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]ethanamide

Systemtic Name: 2-(4-hexadecoxy-2-methoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]ethanamide Openeye Name: 2-(4-hexadecoxy-2-methoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]acetamide CAS Name: 2-(4-hexadecoxy-2-methoxyphenoxy)-N-[2-(1-methyl-2-pyridin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(4-hexadecoxy-2-methoxyphenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]acetamide Traditional Name: 2-(4-cetyloxy-2-methoxy-phenoxy)-N-[2-(1-methylpyridin-1-ium-2-yl)ethyl]acetamide Formula: C33H53N2O4+ MolecularWeight: 541.78492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=CC=CC=[N+]2C)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=CC=CC=[N+]2C)OC

InChI

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