2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one

Systemtic Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one Openeye Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one CAS Name: 2-[(E)-2-(5-nitro-2-furanyl)ethenyl]-3-[2-(trifluoromethyl)phenyl]-4-quinazolinone IUPAC Name: 2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one Traditional Name: 2-[(E)-2-(5-nitro-2-furyl)vinyl]-3-[2-(trifluoromethyl)phenyl]quinazolin-4-one Formula: C21H12F3N3O4 MolecularWeight: 427.33289

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)C=CC3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)/C=C/C3=CC=C(O3)[N+](=O)[O-])C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C21H12F3N3O4/c22-21(23,24)15-6-2-4-8-17(15)26-18(11-9-13-10-12-19(31-13)27(29)30)25-16-7-3-1-5-14(16)20(26)28/h1-12H/b11-9+