N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]-N-[(1-methylpyridin-1-ium-4-yl)methyl]methanesulfonamide iodide

Systemtic Name: N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]-N-[(1-methylpyridin-1-ium-4-yl)methyl]methanesulfonamide iodide Openeye Name: N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]-N-[(1-methylpyridin-1-ium-4-yl)methyl]methanesulfonamide iodide CAS Name: N-[(3-methoxy-4-tetradecoxyphenyl)methyl]-N-[(1-methyl-4-pyridin-1-iumyl)methyl]methanesulfonamide iodide IUPAC Name: N-[(3-methoxy-4-tetradecoxyphenyl)methyl]-N-[(1-methylpyridin-1-ium-4-yl)methyl]methanesulfonamide iodide Traditional Name: N-(3-methoxy-4-myristyloxy-benzyl)-N-[(1-methylpyridin-1-ium-4-yl)methyl]methanesulfonamide iodide Formula: C30H49IN2O4S MolecularWeight: 660.69053

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=[N+](C=C2)C)S(=O)(=O)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=[N+](C=C2)C)S(=O)(=O)C)OC.[I-]

InChI

InChI=1S/C30H49N2O4S.HI/c1-5-6-7-8-9-10-11-12-13-14-15-16-23-36-29-18-17-28(24-30(29)35-3)26-32(37(4,33)34)25-27-19-21-31(2)22-20-27;/h17-22,24H,5-16,23,25-26H2,1-4H3;1H/q+1;/p-1