N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]methanesulfonamide iodide

Systemtic Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]methanesulfonamide iodide Openeye Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(3-methoxy-4-tetradecoxy-phenyl)methyl]methanesulfonamide iodide CAS Name: N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-N-[(3-methoxy-4-tetradecoxyphenyl)methyl]methanesulfonamide iodide IUPAC Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-[(3-methoxy-4-tetradecoxyphenyl)methyl]methanesulfonamide iodide Traditional Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-N-(3-methoxy-4-myristyloxy-benzyl)methanesulfonamide iodide Formula: C31H51IN2O4S MolecularWeight: 674.71711

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=CC=[N+]2CC)S(=O)(=O)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)CN(CC2=CC=CC=[N+]2CC)S(=O)(=O)C)OC.[I-]

InChI

InChI=1S/C31H51N2O4S.HI/c1-5-7-8-9-10-11-12-13-14-15-16-19-24-37-30-22-21-28(25-31(30)36-3)26-33(38(4,34)35)27-29-20-17-18-23-32(29)6-2;/h17-18,20-23,25H,5-16,19,24,26-27H2,1-4H3;1H/q+1;/p-1