[4-[(3-bromophenyl)amino]quinazolin-2-yl]methyl-dimethyl-azanium

Systemtic Name: [4-[(3-bromophenyl)amino]quinazolin-2-yl]methyl-dimethyl-azanium Openeye Name: [4-(3-bromoanilino)quinazolin-2-yl]methyl-dimethyl-ammonium CAS Name: [4-(3-bromoanilino)-2-quinazolinyl]methyl-dimethylammonium IUPAC Name: [4-(3-bromoanilino)quinazolin-2-yl]methyl-dimethylazanium Traditional Name: [4-(3-bromoanilino)quinazolin-2-yl]methyl-dimethyl-ammonium Formula: C17H18BrN4+ MolecularWeight: 358.25562

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=NC2=CC=CC=C2C(=N1)NC3=CC(=CC=C3)Br

Isomeric SMILES

C[NH+](C)CC1=NC2=CC=CC=C2C(=N1)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C17H17BrN4/c1-22(2)11-16-20-15-9-4-3-8-14(15)17(21-16)19-13-7-5-6-12(18)10-13/h3-10H,11H2,1-2H3,(H,19,20,21)/p+1