N-[3-[(3,4-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(4-tetradecoxyphenyl)ethanamide bromide

Systemtic Name: N-[3-[(3,4-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(4-tetradecoxyphenyl)ethanamide bromide Openeye Name: N-[3-[(3,4-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(4-tetradecoxyphenyl)acetamide bromide CAS Name: N-[3-[(3,4-dimethyl-1-pyridin-1-iumyl)methyl]phenyl]-2-(4-tetradecoxyphenyl)acetamide bromide IUPAC Name: N-[3-[(3,4-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(4-tetradecoxyphenyl)acetamide bromide Traditional Name: N-[3-[(3,4-dimethylpyridin-1-ium-1-yl)methyl]phenyl]-2-(4-myristyloxyphenyl)acetamide bromide Formula: C36H51BrN2O2 MolecularWeight: 623.70634

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)C[N+]3=CC(=C(C=C3)C)C.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)CC(=O)NC2=CC=CC(=C2)C[N+]3=CC(=C(C=C3)C)C.[Br-]

InChI

InChI=1S/C36H50N2O2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-25-40-35-21-19-32(20-22-35)27-36(39)37-34-18-16-17-33(26-34)29-38-24-23-30(2)31(3)28-38;/h16-24,26,28H,4-15,25,27,29H2,1-3H3;1H