N,N-bis(2-methylpropyl)-2-(4-nitrophenyl)quinazolin-4-amine chloride

Systemtic Name: N,N-bis(2-methylpropyl)-2-(4-nitrophenyl)quinazolin-4-amine chloride Openeye Name: N,N-diisobutyl-2-(4-nitrophenyl)quinazolin-4-amine chloride CAS Name: N,N-bis(2-methylpropyl)-2-(4-nitrophenyl)-4-quinazolinamine chloride IUPAC Name: N,N-bis(2-methylpropyl)-2-(4-nitrophenyl)quinazolin-4-amine chloride Traditional Name: diisobutyl-[2-(4-nitrophenyl)quinazolin-4-yl]amine chloride Formula: C22H26ClN4O2- MolecularWeight: 413.92044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

Isomeric SMILES

CC(C)CN(CC(C)C)C1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C22H26N4O2.ClH/c1-15(2)13-25(14-16(3)4)22-19-7-5-6-8-20(19)23-21(24-22)17-9-11-18(12-10-17)26(27)28;/h5-12,15-16H,13-14H2,1-4H3;1H/p-1