3-[1-(4-nitronaphthalen-1-yl)propylidene]-2-benzofuran-1-one

Systemtic Name: 3-[1-(4-nitronaphthalen-1-yl)propylidene]-2-benzofuran-1-one Openeye Name: 3-[1-(4-nitro-1-naphthyl)propylidene]isobenzofuran-1-one CAS Name: 3-[1-(4-nitro-1-naphthalenyl)propylidene]-1-isobenzofuranone IUPAC Name: 3-[1-(4-nitronaphthalen-1-yl)propylidene]-2-benzofuran-1-one Traditional Name: 3-[1-(4-nitro-1-naphthyl)propylidene]phthalide Formula: C21H15NO4 MolecularWeight: 345.3481

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C2=CC=CC=C2C(=O)O1)C3=CC=C(C4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CCC(=C1C2=CC=CC=C2C(=O)O1)C3=CC=C(C4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C21H15NO4/c1-2-13(20-17-9-5-6-10-18(17)21(23)26-20)15-11-12-19(22(24)25)16-8-4-3-7-14(15)16/h3-12H,2H2,1H3