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

Systemtic Name: N-(2-methylcyclohexyl)-2-(4-nitrophenyl)quinazolin-4-amine Openeye Name: N-(2-methylcyclohexyl)-2-(4-nitrophenyl)quinazolin-4-amine CAS Name: N-(2-methylcyclohexyl)-2-(4-nitrophenyl)-4-quinazolinamine IUPAC Name: N-(2-methylcyclohexyl)-2-(4-nitrophenyl)quinazolin-4-amine Traditional Name: (2-methylcyclohexyl)-[2-(4-nitrophenyl)quinazolin-4-yl]amine Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCC1NC2=NC(=NC3=CC=CC=C32)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O2/c1-14-6-2-4-8-18(14)22-21-17-7-3-5-9-19(17)23-20(24-21)15-10-12-16(13-11-15)25(26)27/h3,5,7,9-14,18H,2,4,6,8H2,1H3,(H,22,23,24)