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

Systemtic Name: (3-methoxy-4-tetradecoxy-phenyl)methyl N-(2-methoxyphenyl)carbonyl-N-[(1-methylpyridin-1-ium-3-yl)methyl]carbamate iodide Openeye Name: (3-methoxy-4-tetradecoxy-phenyl)methyl N-(2-methoxybenzoyl)-N-[(1-methylpyridin-1-ium-3-yl)methyl]carbamate iodide CAS Name: N-[(2-methoxyphenyl)-oxomethyl]-N-[(1-methyl-3-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-methylpyridin-1-ium-3-yl)methyl]carbamate iodide Traditional Name: N-[(1-methylpyridin-1-ium-3-yl)methyl]-N-o-anisoyl-carbamic acid (3-methoxy-4-myristyloxy-benzyl) ester iodide Formula: C38H53IN2O6 MolecularWeight: 760.74169

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=C[N+](=CC=C2)C)C(=O)C3=CC=CC=C3OC)OC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCOC1=C(C=C(C=C1)COC(=O)N(CC2=C[N+](=CC=C2)C)C(=O)C3=CC=CC=C3OC)OC.[I-]

InChI

InChI=1S/C38H53N2O6.HI/c1-5-6-7-8-9-10-11-12-13-14-15-18-26-45-35-24-23-31(27-36(35)44-4)30-46-38(42)40(29-32-20-19-25-39(2)28-32)37(41)33-21-16-17-22-34(33)43-3;/h16-17,19-25,27-28H,5-15,18,26,29-30H2,1-4H3;1H/q+1;/p-1