N-(2-methylpropyl)-2-(4-nitrophenyl)quinazolin-4-amine

Systemtic Name: N-(2-methylpropyl)-2-(4-nitrophenyl)quinazolin-4-amine Openeye Name: N-isobutyl-2-(4-nitrophenyl)quinazolin-4-amine CAS Name: N-(2-methylpropyl)-2-(4-nitrophenyl)-4-quinazolinamine IUPAC Name: N-(2-methylpropyl)-2-(4-nitrophenyl)quinazolin-4-amine Traditional Name: isobutyl-[2-(4-nitrophenyl)quinazolin-4-yl]amine Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CNC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O2/c1-12(2)11-19-18-15-5-3-4-6-16(15)20-17(21-18)13-7-9-14(10-8-13)22(23)24/h3-10,12H,11H2,1-2H3,(H,19,20,21)