[4-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[(4-bromanyl-2,6-dimethyl-phenyl)amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-(4-bromo-2,6-dimethyl-anilino)-4-oxo-butyl]ammonium CAS Name: [4-(4-bromo-2,6-dimethylanilino)-4-oxobutyl]ammonium IUPAC Name: [4-(4-bromo-2,6-dimethylanilino)-4-oxobutyl]azanium Traditional Name: [4-(4-bromo-2,6-dimethyl-anilino)-4-keto-butyl]ammonium Formula: C12H18BrN2O+ MolecularWeight: 286.18812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)CCC[NH3+])C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)CCC[NH3+])C)Br

InChI

InChI=1S/C12H17BrN2O/c1-8-6-10(13)7-9(2)12(8)15-11(16)4-3-5-14/h6-7H,3-5,14H2,1-2H3,(H,15,16)/p+1