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

Systemtic Name: N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-3-yl)methyl]methanesulfonamide iodide Openeye Name: N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]-N-[(1-propylpyridin-1-ium-3-yl)methyl]methanesulfonamide iodide CAS Name: N-[(3-methoxy-4-tetradecoxyphenyl)methyl]-N-[(1-propyl-3-pyridin-1-iumyl)methyl]methanesulfonamide iodide IUPAC Name: N-[(3-methoxy-4-tetradecoxyphenyl)methyl]-N-[(1-propylpyridin-1-ium-3-yl)methyl]methanesulfonamide iodide Traditional Name: N-(3-methoxy-4-myristyloxy-benzyl)-N-[(1-propylpyridin-1-ium-3-yl)methyl]methanesulfonamide iodide Formula: C32H53IN2O4S MolecularWeight: 688.74369

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H53N2O4S.HI/c1-5-7-8-9-10-11-12-13-14-15-16-17-24-38-31-21-20-29(25-32(31)37-3)27-34(39(4,35)36)28-30-19-18-23-33(26-30)22-6-2;/h18-21,23,25-26H,5-17,22,24,27-28H2,1-4H3;1H/q+1;/p-1