(2Z)-6-(3-methylbut-2-enoxy)-2-[(3-nitrophenyl)methylidene]-1-benzofuran-3-one

Systemtic Name: (2Z)-6-(3-methylbut-2-enoxy)-2-[(3-nitrophenyl)methylidene]-1-benzofuran-3-one Openeye Name: (2Z)-6-(3-methylbut-2-enoxy)-2-[(3-nitrophenyl)methylene]benzofuran-3-one CAS Name: (2Z)-6-(3-methylbut-2-enoxy)-2-[(3-nitrophenyl)methylidene]-3-benzofuranone IUPAC Name: (2Z)-6-(3-methylbut-2-enoxy)-2-[(3-nitrophenyl)methylidene]-1-benzofuran-3-one Traditional Name: (2Z)-6-(3-methylbut-2-enoxy)-2-(3-nitrobenzylidene)coumaran-3-one Formula: C20H17NO5 MolecularWeight: 351.35268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=CC2=C(C=C1)C(=O)C(=CC3=CC(=CC=C3)[N+](=O)[O-])O2)C

Isomeric SMILES

CC(=CCOC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC(=CC=C3)[N+](=O)[O-])/O2)C

InChI

InChI=1S/C20H17NO5/c1-13(2)8-9-25-16-6-7-17-18(12-16)26-19(20(17)22)11-14-4-3-5-15(10-14)21(23)24/h3-8,10-12H,9H2,1-2H3/b19-11-