(2-methyl-1-phenyl-propan-2-yl)-[2-(4-oxidanylidenequinazolin-3-yl)ethyl]azanium bromide

Systemtic Name: (2-methyl-1-phenyl-propan-2-yl)-[2-(4-oxidanylidenequinazolin-3-yl)ethyl]azanium bromide Openeye Name: (1,1-dimethyl-2-phenyl-ethyl)-[2-(4-oxoquinazolin-3-yl)ethyl]ammonium bromide CAS Name: (2-methyl-1-phenylpropan-2-yl)-[2-(4-oxo-3-quinazolinyl)ethyl]ammonium bromide IUPAC Name: (2-methyl-1-phenylpropan-2-yl)-[2-(4-oxoquinazolin-3-yl)ethyl]azanium bromide Traditional Name: (1,1-dimethyl-2-phenyl-ethyl)-[2-(4-ketoquinazolin-3-yl)ethyl]ammonium bromide Formula: C20H24BrN3O MolecularWeight: 402.32806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC1=CC=CC=C1)[NH2+]CCN2C=NC3=CC=CC=C3C2=O.[Br-]

Isomeric SMILES

CC(C)(CC1=CC=CC=C1)[NH2+]CCN2C=NC3=CC=CC=C3C2=O.[Br-]

InChI

InChI=1S/C20H23N3O.BrH/c1-20(2,14-16-8-4-3-5-9-16)22-12-13-23-15-21-18-11-7-6-10-17(18)19(23)24;/h3-11,15,22H,12-14H2,1-2H3;1H