4-methyl-N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]benzenesulfonamide Openeye Name: 4-methyl-N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-[(2-methyl-3-tetradecoxy-phenyl)methyl]benzenesulfonamide CAS Name: 4-methyl-N-[(1-methyl-3-pyridin-1-iumyl)methyl]-N-[(2-methyl-3-tetradecoxyphenyl)methyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-[(2-methyl-3-tetradecoxyphenyl)methyl]benzenesulfonamide Traditional Name: 4-methyl-N-(2-methyl-3-myristyloxy-benzyl)-N-[(1-methylpyridin-1-ium-3-yl)methyl]benzenesulfonamide Formula: C36H53N2O3S+ MolecularWeight: 593.88262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=CC(=C1C)CN(CC2=C[N+](=CC=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=CC(=C1C)CN(CC2=C[N+](=CC=C2)C)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C36H53N2O3S/c1-5-6-7-8-9-10-11-12-13-14-15-16-27-41-36-21-17-20-34(32(36)3)30-38(29-33-19-18-26-37(4)28-33)42(39,40)35-24-22-31(2)23-25-35/h17-26,28H,5-16,27,29-30H2,1-4H3/q+1