2-(2-chloranyl-4-decoxy-phenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]ethanamide

Systemtic Name: 2-(2-chloranyl-4-decoxy-phenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]ethanamide Openeye Name: 2-(2-chloro-4-decoxy-phenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]acetamide CAS Name: 2-(2-chloro-4-decoxyphenyl)-N-[(1-ethyl-2-pyridin-1-iumyl)methyl]acetamide IUPAC Name: 2-(2-chloro-4-decoxyphenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]acetamide Traditional Name: 2-(2-chloro-4-decoxy-phenyl)-N-[(1-ethylpyridin-1-ium-2-yl)methyl]acetamide Formula: C26H38ClN2O2+ MolecularWeight: 446.04512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC(=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2CC)Cl

Isomeric SMILES

CCCCCCCCCCOC1=CC(=C(C=C1)CC(=O)NCC2=CC=CC=[N+]2CC)Cl

InChI

InChI=1S/C26H37ClN2O2/c1-3-5-6-7-8-9-10-13-18-31-24-16-15-22(25(27)20-24)19-26(30)28-21-23-14-11-12-17-29(23)4-2/h11-12,14-17,20H,3-10,13,18-19,21H2,1-2H3/p+1