N-(4-tert-butylphenyl)-6-nitro-quinazolin-4-amine

Systemtic Name: N-(4-tert-butylphenyl)-6-nitro-quinazolin-4-amine Openeye Name: N-(4-tert-butylphenyl)-6-nitro-quinazolin-4-amine CAS Name: N-(4-tert-butylphenyl)-6-nitro-4-quinazolinamine IUPAC Name: N-(4-tert-butylphenyl)-6-nitroquinazolin-4-amine Traditional Name: (4-tert-butylphenyl)-(6-nitroquinazolin-4-yl)amine Formula: C18H18N4O2 MolecularWeight: 322.36112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)NC2=NC=NC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O2/c1-18(2,3)12-4-6-13(7-5-12)21-17-15-10-14(22(23)24)8-9-16(15)19-11-20-17/h4-11H,1-3H3,(H,19,20,21)