[3-[4-(bromomethyl)phenyl]-2-oxidanyl-3-oxidanylidene-propyl]-trimethyl-azanium

Systemtic Name: [3-[4-(bromomethyl)phenyl]-2-oxidanyl-3-oxidanylidene-propyl]-trimethyl-azanium Openeye Name: [3-[4-(bromomethyl)phenyl]-2-hydroxy-3-oxo-propyl]-trimethyl-ammonium CAS Name: [3-[4-(bromomethyl)phenyl]-2-hydroxy-3-oxopropyl]-trimethylammonium IUPAC Name: [3-[4-(bromomethyl)phenyl]-2-hydroxy-3-oxopropyl]-trimethylazanium Traditional Name: [3-[4-(bromomethyl)phenyl]-2-hydroxy-3-keto-propyl]-trimethyl-ammonium Formula: C13H19BrNO2+ MolecularWeight: 301.19946

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(C(=O)C1=CC=C(C=C1)CBr)O

Isomeric SMILES

C[N+](C)(C)CC(C(=O)C1=CC=C(C=C1)CBr)O

InChI

InChI=1S/C13H19BrNO2/c1-15(2,3)9-12(16)13(17)11-6-4-10(8-14)5-7-11/h4-7,12,16H,8-9H2,1-3H3/q+1