(3-methoxy-4-tetradecoxy-phenyl)methyl N-(2-methoxyphenyl)carbonyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamate iodide

Systemtic Name: (3-methoxy-4-tetradecoxy-phenyl)methyl N-(2-methoxyphenyl)carbonyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamate iodide Openeye Name: (3-methoxy-4-tetradecoxy-phenyl)methyl N-(2-methoxybenzoyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamate iodide CAS Name: N-[(2-methoxyphenyl)-oxomethyl]-N-[(1-propyl-2-pyridin-1-iumyl)methyl]carbamic acid (3-methoxy-4-tetradecoxyphenyl)methyl ester iodide IUPAC Name: (3-methoxy-4-tetradecoxyphenyl)methyl N-(2-methoxybenzoyl)-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamate iodide Traditional Name: N-o-anisoyl-N-[(1-propylpyridin-1-ium-2-yl)methyl]carbamic acid (3-methoxy-4-myristyloxy-benzyl) ester iodide Formula: C40H57IN2O6 MolecularWeight: 788.79485

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=CC=CC=[N+]2CCC)C(=O)C3=CC=CC=C3OC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=CC=CC=[N+]2CCC)C(=O)C3=CC=CC=C3OC)OC.[I-]

InChI

InChI=1S/C40H57N2O6.HI/c1-5-7-8-9-10-11-12-13-14-15-16-21-29-47-37-26-25-33(30-38(37)46-4)32-48-40(44)42(31-34-22-19-20-28-41(34)27-6-2)39(43)35-23-17-18-24-36(35)45-3;/h17-20,22-26,28,30H,5-16,21,27,29,31-32H2,1-4H3;1H/q+1;/p-1