3-[[4-nitro-3-(trifluoromethyl)phenyl]amino]-3H-2-benzofuran-1-one

Systemtic Name: 3-[[4-nitro-3-(trifluoromethyl)phenyl]amino]-3H-2-benzofuran-1-one Openeye Name: 3-[4-nitro-3-(trifluoromethyl)anilino]-3H-isobenzofuran-1-one CAS Name: 3-[4-nitro-3-(trifluoromethyl)anilino]-3H-isobenzofuran-1-one IUPAC Name: 3-[4-nitro-3-(trifluoromethyl)anilino]-3H-2-benzofuran-1-one Traditional Name: 3-[4-nitro-3-(trifluoromethyl)anilino]phthalide Formula: C15H9F3N2O4 MolecularWeight: 338.23817

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC2=O)NC3=CC(=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(OC2=O)NC3=CC(=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H9F3N2O4/c16-15(17,18)11-7-8(5-6-12(11)20(22)23)19-13-9-3-1-2-4-10(9)14(21)24-13/h1-7,13,19H