N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-(4-tetradecoxyphenyl)ethanamide

Systemtic Name: N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-(4-tetradecoxyphenyl)ethanamide Openeye Name: N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-(4-tetradecoxyphenyl)acetamide CAS Name: N-[(1-methyl-3-pyridin-1-iumyl)methyl]-N-(4-tetradecoxyphenyl)acetamide IUPAC Name: N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-(4-tetradecoxyphenyl)acetamide Traditional Name: N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-(4-myristyloxyphenyl)acetamide Formula: C29H45N2O2+ MolecularWeight: 453.6798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)N(CC2=C[N+](=CC=C2)C)C(=O)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)N(CC2=C[N+](=CC=C2)C)C(=O)C

InChI

InChI=1S/C29H45N2O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-23-33-29-20-18-28(19-21-29)31(26(2)32)25-27-17-16-22-30(3)24-27/h16-22,24H,4-15,23,25H2,1-3H3/q+1