[1-(3,4-dimethoxyphenyl)carbonyloxy-1-phenyl-propan-2-yl]-trimethyl-azanium iodide

Systemtic Name: [1-(3,4-dimethoxyphenyl)carbonyloxy-1-phenyl-propan-2-yl]-trimethyl-azanium iodide Openeye Name: [2-(3,4-dimethoxybenzoyl)oxy-1-methyl-2-phenyl-ethyl]-trimethyl-ammonium iodide CAS Name: [1-[(3,4-dimethoxyphenyl)-oxomethoxy]-1-phenylpropan-2-yl]-trimethylammonium iodide IUPAC Name: [1-(3,4-dimethoxybenzoyl)oxy-1-phenylpropan-2-yl]-trimethylazanium iodide Traditional Name: trimethyl-(1-methyl-2-phenyl-2-veratroyloxy-ethyl)ammonium iodide Formula: C21H28INO4 MolecularWeight: 485.35579

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)OC)OC)[N+](C)(C)C.[I-]

Isomeric SMILES

CC(C(C1=CC=CC=C1)OC(=O)C2=CC(=C(C=C2)OC)OC)[N+](C)(C)C.[I-]

InChI

InChI=1S/C21H28NO4.HI/c1-15(22(2,3)4)20(16-10-8-7-9-11-16)26-21(23)17-12-13-18(24-5)19(14-17)25-6;/h7-15,20H,1-6H3;1H/q+1;/p-1