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

Systemtic Name: 3-[(4-fluoranyl-3-nitro-phenyl)amino]-3H-2-benzofuran-1-one Openeye Name: 3-(4-fluoro-3-nitro-anilino)-3H-isobenzofuran-1-one CAS Name: 3-(4-fluoro-3-nitroanilino)-3H-isobenzofuran-1-one IUPAC Name: 3-(4-fluoro-3-nitroanilino)-3H-2-benzofuran-1-one Traditional Name: 3-(4-fluoro-3-nitro-anilino)phthalide Formula: C14H9FN2O4 MolecularWeight: 288.230663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H9FN2O4/c15-11-6-5-8(7-12(11)17(19)20)16-13-9-3-1-2-4-10(9)14(18)21-13/h1-7,13,16H