2-(2-chloranyl-4-dodecoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]ethanamide

Systemtic Name: 2-(2-chloranyl-4-dodecoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]ethanamide Openeye Name: 2-(2-chloro-4-dodecoxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide CAS Name: 2-(2-chloro-4-dodecoxyphenoxy)-N-[2-(1-ethyl-4-pyridin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(2-chloro-4-dodecoxyphenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide Traditional Name: 2-(2-chloro-4-lauryloxy-phenoxy)-N-[2-(1-ethylpyridin-1-ium-4-yl)ethyl]acetamide Formula: C29H44ClN2O3+ MolecularWeight: 504.12426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=CC=[N+](C=C2)CC)Cl

Isomeric SMILES

CCCCCCCCCCCCOC1=CC(=C(C=C1)OCC(=O)NCCC2=CC=[N+](C=C2)CC)Cl

InChI

InChI=1S/C29H43ClN2O3/c1-3-5-6-7-8-9-10-11-12-13-22-34-26-14-15-28(27(30)23-26)35-24-29(33)31-19-16-25-17-20-32(4-2)21-18-25/h14-15,17-18,20-21,23H,3-13,16,19,22,24H2,1-2H3/p+1