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

Systemtic Name: 3-[(2-methyl-4-nitro-phenyl)amino]-3H-2-benzofuran-1-one Openeye Name: 3-(2-methyl-4-nitro-anilino)-3H-isobenzofuran-1-one CAS Name: 3-(2-methyl-4-nitroanilino)-3H-isobenzofuran-1-one IUPAC Name: 3-(2-methyl-4-nitroanilino)-3H-2-benzofuran-1-one Traditional Name: 3-(2-methyl-4-nitro-anilino)phthalide Formula: C15H12N2O4 MolecularWeight: 284.26678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C15H12N2O4/c1-9-8-10(17(19)20)6-7-13(9)16-14-11-4-2-3-5-12(11)15(18)21-14/h2-8,14,16H,1H3