2-(2-chloranyl-4-dodecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]ethanamide

Systemtic Name: 2-(2-chloranyl-4-dodecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]ethanamide Openeye Name: 2-(2-chloro-4-dodecoxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]acetamide CAS Name: 2-(2-chloro-4-dodecoxyphenoxy)-N-[2-(1-propyl-3-pyridin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(2-chloro-4-dodecoxyphenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]acetamide Traditional Name: 2-(2-chloro-4-lauryloxy-phenoxy)-N-[2-(1-propylpyridin-1-ium-3-yl)ethyl]acetamide Formula: C30H46ClN2O3+ MolecularWeight: 518.15084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H45ClN2O3/c1-3-5-6-7-8-9-10-11-12-13-22-35-27-16-17-29(28(31)23-27)36-25-30(34)32-19-18-26-15-14-21-33(24-26)20-4-2/h14-17,21,23-24H,3-13,18-20,22,25H2,1-2H3/p+1