2-[(3-nitrophenyl)methylidene]-6-(2-oxidanylidenepropoxy)-1-benzofuran-3-one

Systemtic Name: 2-[(3-nitrophenyl)methylidene]-6-(2-oxidanylidenepropoxy)-1-benzofuran-3-one Openeye Name: 6-acetonyloxy-2-[(3-nitrophenyl)methylene]benzofuran-3-one CAS Name: 2-[(3-nitrophenyl)methylidene]-6-(2-oxopropoxy)-3-benzofuranone IUPAC Name: 2-[(3-nitrophenyl)methylidene]-6-(2-oxopropoxy)-1-benzofuran-3-one Traditional Name: 6-acetonyloxy-2-(3-nitrobenzylidene)coumaran-3-one Formula: C18H13NO6 MolecularWeight: 339.29892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC=C3)[N+](=O)[O-])O2

Isomeric SMILES

CC(=O)COC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC=C3)[N+](=O)[O-])O2

InChI

InChI=1S/C18H13NO6/c1-11(20)10-24-14-5-6-15-16(9-14)25-17(18(15)21)8-12-3-2-4-13(7-12)19(22)23/h2-9H,10H2,1H3