[2-[(3-bromophenyl)methyl]-3-methoxy-3-oxidanylidene-propyl]-trimethyl-azanium iodide

Systemtic Name: [2-[(3-bromophenyl)methyl]-3-methoxy-3-oxidanylidene-propyl]-trimethyl-azanium iodide Openeye Name: [2-[(3-bromophenyl)methyl]-3-methoxy-3-oxo-propyl]-trimethyl-ammonium iodide CAS Name: [2-[(3-bromophenyl)methyl]-3-methoxy-3-oxopropyl]-trimethylammonium iodide IUPAC Name: [2-[(3-bromophenyl)methyl]-3-methoxy-3-oxopropyl]-trimethylazanium iodide Traditional Name: [2-(3-bromobenzyl)-3-keto-3-methoxy-propyl]-trimethyl-ammonium iodide Formula: C14H21BrINO2 MolecularWeight: 442.13051

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC1=CC(=CC=C1)Br)C(=O)OC.[I-]

Isomeric SMILES

C[N+](C)(C)CC(CC1=CC(=CC=C1)Br)C(=O)OC.[I-]

InChI

InChI=1S/C14H21BrNO2.HI/c1-16(2,3)10-12(14(17)18-4)8-11-6-5-7-13(15)9-11;/h5-7,9,12H,8,10H2,1-4H3;1H/q+1;/p-1