(3,5-dimethoxy-4-tetradecoxy-phenyl)methyl N-ethanoyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate iodide

Systemtic Name: (3,5-dimethoxy-4-tetradecoxy-phenyl)methyl N-ethanoyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate iodide Openeye Name: (3,5-dimethoxy-4-tetradecoxy-phenyl)methyl N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate iodide CAS Name: N-acetyl-N-[(1-methyl-2-pyridin-1-iumyl)methyl]carbamic acid (3,5-dimethoxy-4-tetradecoxyphenyl)methyl ester iodide IUPAC Name: (3,5-dimethoxy-4-tetradecoxyphenyl)methyl N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamate iodide Traditional Name: N-acetyl-N-[(1-methylpyridin-1-ium-2-yl)methyl]carbamic acid (3,5-dimethoxy-4-myristyloxy-benzyl) ester iodide Formula: C33H51IN2O6 MolecularWeight: 698.67231

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1OC)COC(=O)N(CC2=CC=CC=[N+]2C)C(=O)C)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1OC)COC(=O)N(CC2=CC=CC=[N+]2C)C(=O)C)OC.[I-]

InChI

InChI=1S/C33H51N2O6.HI/c1-6-7-8-9-10-11-12-13-14-15-16-19-22-40-32-30(38-4)23-28(24-31(32)39-5)26-41-33(37)35(27(2)36)25-29-20-17-18-21-34(29)3;/h17-18,20-21,23-24H,6-16,19,22,25-26H2,1-5H3;1H/q+1;/p-1