(4-azanyl-4-oxidanylidene-3,3-diphenyl-butyl)-dimethyl-propan-2-yl-azanium bromide

Systemtic Name: (4-azanyl-4-oxidanylidene-3,3-diphenyl-butyl)-dimethyl-propan-2-yl-azanium bromide Openeye Name: (4-amino-4-oxo-3,3-diphenyl-butyl)-isopropyl-dimethyl-ammonium bromide CAS Name: (4-amino-4-oxo-3,3-diphenylbutyl)-dimethyl-propan-2-ylammonium bromide IUPAC Name: (4-amino-4-oxo-3,3-diphenylbutyl)-dimethyl-propan-2-ylazanium bromide Traditional Name: (4-amino-4-keto-3,3-diphenyl-butyl)-isopropyl-dimethyl-ammonium bromide Formula: C21H29BrN2O MolecularWeight: 405.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+](C)(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N.[Br-]

Isomeric SMILES

CC(C)[N+](C)(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N.[Br-]

InChI

InChI=1S/C21H28N2O.BrH/c1-17(2)23(3,4)16-15-21(20(22)24,18-11-7-5-8-12-18)19-13-9-6-10-14-19;/h5-14,17H,15-16H2,1-4H3,(H-,22,24);1H