N-(4-chloranyl-2-fluoranyl-phenyl)-1-(2-methoxyethoxy)-6-nitro-2H-quinazolin-4-amine

Systemtic Name: N-(4-chloranyl-2-fluoranyl-phenyl)-1-(2-methoxyethoxy)-6-nitro-2H-quinazolin-4-amine Openeye Name: N-(4-chloro-2-fluoro-phenyl)-1-(2-methoxyethoxy)-6-nitro-2H-quinazolin-4-amine CAS Name: N-(4-chloro-2-fluorophenyl)-1-(2-methoxyethoxy)-6-nitro-2H-quinazolin-4-amine IUPAC Name: N-(4-chloro-2-fluorophenyl)-1-(2-methoxyethoxy)-6-nitro-2H-quinazolin-4-amine Traditional Name: (4-chloro-2-fluoro-phenyl)-[1-(2-methoxyethoxy)-6-nitro-2H-quinazolin-4-yl]amine Formula: C17H16ClFN4O4 MolecularWeight: 394.784743

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Descriptors Computed from Structure

Canonical SMILES:

COCCON1CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])NC3=C(C=C(C=C3)Cl)F

Isomeric SMILES

COCCON1CN=C(C2=C1C=CC(=C2)[N+](=O)[O-])NC3=C(C=C(C=C3)Cl)F

InChI

InChI=1S/C17H16ClFN4O4/c1-26-6-7-27-22-10-20-17(21-15-4-2-11(18)8-14(15)19)13-9-12(23(24)25)3-5-16(13)22/h2-5,8-9H,6-7,10H2,1H3,(H,20,21)