bis(2-methylpropyl)-[2-(4-nitrophenyl)quinazolin-4-yl]azanium chloride

Systemtic Name: bis(2-methylpropyl)-[2-(4-nitrophenyl)quinazolin-4-yl]azanium chloride Openeye Name: diisobutyl-[2-(4-nitrophenyl)quinazolin-4-yl]ammonium chloride CAS Name: bis(2-methylpropyl)-[2-(4-nitrophenyl)-4-quinazolinyl]ammonium chloride IUPAC Name: bis(2-methylpropyl)-[2-(4-nitrophenyl)quinazolin-4-yl]azanium chloride Traditional Name: diisobutyl-[2-(4-nitrophenyl)quinazolin-4-yl]ammonium chloride Formula: C22H27ClN4O2 MolecularWeight: 414.92838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)C[NH+](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