[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-dimethyl-(2-oxidanylidenepropyl)azanium bromide

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl]-dimethyl-(2-oxidanylidenepropyl)azanium bromide Openeye Name: acetonyl-[2-(4-methoxyphenyl)-2-oxo-ethyl]-dimethyl-ammonium bromide CAS Name: [2-(4-methoxyphenyl)-2-oxoethyl]-dimethyl-(2-oxopropyl)ammonium bromide IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl]-dimethyl-(2-oxopropyl)azanium bromide Traditional Name: acetonyl-[2-keto-2-(4-methoxyphenyl)ethyl]-dimethyl-ammonium bromide Formula: C14H20BrNO3 MolecularWeight: 330.2175

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20NO3.BrH/c1-11(16)9-15(2,3)10-14(17)12-5-7-13(18-4)8-6-12;/h5-8H,9-10H2,1-4H3;1H/q+1;/p-1