3-[(2,3-dimethylnaphthalen-1-yl)-nitro-methylidene]-2-benzofuran-1-one

Systemtic Name: 3-[(2,3-dimethylnaphthalen-1-yl)-nitro-methylidene]-2-benzofuran-1-one Openeye Name: 3-[(2,3-dimethyl-1-naphthyl)-nitro-methylene]isobenzofuran-1-one CAS Name: 3-[(2,3-dimethyl-1-naphthalenyl)-nitromethylidene]-1-isobenzofuranone IUPAC Name: 3-[(2,3-dimethylnaphthalen-1-yl)-nitromethylidene]-2-benzofuran-1-one Traditional Name: 3-[(2,3-dimethyl-1-naphthyl)-nitro-methylene]phthalide Formula: C21H15NO4 MolecularWeight: 345.3481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC=CC=C2C(=C1C)C(=C3C4=CC=CC=C4C(=O)O3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=CC=CC=C2C(=C1C)C(=C3C4=CC=CC=C4C(=O)O3)[N+](=O)[O-]

InChI

InChI=1S/C21H15NO4/c1-12-11-14-7-3-4-8-15(14)18(13(12)2)19(22(24)25)20-16-9-5-6-10-17(16)21(23)26-20/h3-11H,1-2H3