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

Systemtic Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]benzenesulfonamide iodide Openeye Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxy-phenyl)methyl]benzenesulfonamide iodide CAS Name: N-[(1-ethyl-2-pyridin-1-iumyl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxyphenyl)methyl]benzenesulfonamide iodide IUPAC Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-4-methyl-N-[(2-methyl-4-tetradecoxyphenyl)methyl]benzenesulfonamide iodide Traditional Name: N-[(1-ethylpyridin-1-ium-2-yl)methyl]-4-methyl-N-(2-methyl-4-myristyloxy-benzyl)benzenesulfonamide iodide Formula: C37H55IN2O3S MolecularWeight: 734.81367

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)CN(CC2=CC=CC=[N+]2CC)S(=O)(=O)C3=CC=C(C=C3)C)C.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC(=C(C=C1)CN(CC2=CC=CC=[N+]2CC)S(=O)(=O)C3=CC=C(C=C3)C)C.[I-]

InChI

InChI=1S/C37H55N2O3S.HI/c1-5-7-8-9-10-11-12-13-14-15-16-19-28-42-36-24-23-34(33(4)29-36)30-39(31-35-20-17-18-27-38(35)6-2)43(40,41)37-25-21-32(3)22-26-37;/h17-18,20-27,29H,5-16,19,28,30-31H2,1-4H3;1H/q+1;/p-1