4-(3,5-dimethoxy-4-phenylmethoxy-phenyl)carbonyloxybutyl-trimethyl-azanium iodide

Systemtic Name: 4-(3,5-dimethoxy-4-phenylmethoxy-phenyl)carbonyloxybutyl-trimethyl-azanium iodide Openeye Name: 4-(4-benzyloxy-3,5-dimethoxy-benzoyl)oxybutyl-trimethyl-ammonium iodide CAS Name: 4-[(3,5-dimethoxy-4-phenylmethoxyphenyl)-oxomethoxy]butyl-trimethylammonium iodide IUPAC Name: 4-(3,5-dimethoxy-4-phenylmethoxybenzoyl)oxybutyl-trimethylazanium iodide Traditional Name: 4-(4-benzoxy-3,5-dimethoxy-benzoyl)oxybutyl-trimethyl-ammonium iodide Formula: C23H32INO5 MolecularWeight: 529.40835

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCOC(=O)C1=CC(=C(C(=C1)OC)OCC2=CC=CC=C2)OC.[I-]

Isomeric SMILES

C[N+](C)(C)CCCCOC(=O)C1=CC(=C(C(=C1)OC)OCC2=CC=CC=C2)OC.[I-]

InChI

InChI=1S/C23H32NO5.HI/c1-24(2,3)13-9-10-14-28-23(25)19-15-20(26-4)22(21(16-19)27-5)29-17-18-11-7-6-8-12-18;/h6-8,11-12,15-16H,9-10,13-14,17H2,1-5H3;1H/q+1;/p-1