3-(4-nitrophenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-4-one

Systemtic Name: 3-(4-nitrophenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-4-one Openeye Name: 3-(4-nitrobenzoyl)-2-[4-(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-4-one CAS Name: 3-[(4-nitrophenyl)-oxomethyl]-2-[4-(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-4-one IUPAC Name: 3-(4-nitrobenzoyl)-2-[4-(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-4-one Traditional Name: 3-(4-nitrobenzoyl)-2-[4-(trifluoromethyl)phenyl]-2H-1,3-benzoxazin-4-one Formula: C22H13F3N2O5 MolecularWeight: 442.34423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(O2)C3=CC=C(C=C3)C(F)(F)F)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(O2)C3=CC=C(C=C3)C(F)(F)F)C(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H13F3N2O5/c23-22(24,25)15-9-5-14(6-10-15)21-26(20(29)17-3-1-2-4-18(17)32-21)19(28)13-7-11-16(12-8-13)27(30)31/h1-12,21H