N-(3-chloranyl-4-fluoranyl-phenyl)-6-nitro-7-(oxan-4-yloxy)quinazolin-4-amine

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-6-nitro-7-(oxan-4-yloxy)quinazolin-4-amine Openeye Name: N-(3-chloro-4-fluoro-phenyl)-6-nitro-7-tetrahydropyran-4-yloxy-quinazolin-4-amine CAS Name: N-(3-chloro-4-fluorophenyl)-6-nitro-7-(4-oxanyloxy)-4-quinazolinamine IUPAC Name: N-(3-chloro-4-fluorophenyl)-6-nitro-7-(oxan-4-yloxy)quinazolin-4-amine Traditional Name: (3-chloro-4-fluoro-phenyl)-(6-nitro-7-tetrahydropyran-4-yloxy-quinazolin-4-yl)amine Formula: C19H16ClFN4O4 MolecularWeight: 418.806143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1OC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCC1OC2=C(C=C3C(=C2)N=CN=C3NC4=CC(=C(C=C4)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H16ClFN4O4/c20-14-7-11(1-2-15(14)21)24-19-13-8-17(25(26)27)18(9-16(13)22-10-23-19)29-12-3-5-28-6-4-12/h1-2,7-10,12H,3-6H2,(H,22,23,24)