2-adamantylcarbonyloxymethyl-[[3-(dimethylcarbamoyloxy)pyridin-2-yl]methyl]-dimethyl-azanium chloride

Systemtic Name: 2-adamantylcarbonyloxymethyl-[[3-(dimethylcarbamoyloxy)pyridin-2-yl]methyl]-dimethyl-azanium chloride Openeye Name: adamantane-2-carbonyloxymethyl-[[3-(dimethylcarbamoyloxy)-2-pyridyl]methyl]-dimethyl-ammonium chloride CAS Name: [2-adamantyl(oxo)methoxy]methyl-[[3-[dimethylamino(oxo)methoxy]-2-pyridinyl]methyl]-dimethylammonium chloride IUPAC Name: adamantane-2-carbonyloxymethyl-[[3-(dimethylcarbamoyloxy)pyridin-2-yl]methyl]-dimethylazanium chloride Traditional Name: adamantane-2-carbonyloxymethyl-[[3-(dimethylcarbamoyloxy)-2-pyridyl]methyl]-dimethyl-ammonium chloride Formula: C23H34ClN3O4 MolecularWeight: 451.98676

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)OC1=C(N=CC=C1)C[N+](C)(C)COC(=O)C2C3CC4CC(C3)CC2C4.[Cl-]

Isomeric SMILES

CN(C)C(=O)OC1=C(N=CC=C1)C[N+](C)(C)COC(=O)C2C3CC4CC(C3)CC2C4.[Cl-]

InChI

InChI=1S/C23H34N3O4.ClH/c1-25(2)23(28)30-20-6-5-7-24-19(20)13-26(3,4)14-29-22(27)21-17-9-15-8-16(11-17)12-18(21)10-15;/h5-7,15-18,21H,8-14H2,1-4H3;1H/q+1;/p-1