(3E)-5-(3,4-dimethylphenyl)-3-[(2-methyl-5-nitro-phenyl)methylidene]furan-2-one

Systemtic Name: (3E)-5-(3,4-dimethylphenyl)-3-[(2-methyl-5-nitro-phenyl)methylidene]furan-2-one Openeye Name: (3E)-5-(3,4-dimethylphenyl)-3-[(2-methyl-5-nitro-phenyl)methylene]furan-2-one CAS Name: (3E)-5-(3,4-dimethylphenyl)-3-[(2-methyl-5-nitrophenyl)methylidene]-2-furanone IUPAC Name: (3E)-5-(3,4-dimethylphenyl)-3-[(2-methyl-5-nitrophenyl)methylidene]furan-2-one Traditional Name: (3E)-5-(3,4-dimethylphenyl)-3-(2-methyl-5-nitro-benzylidene)furan-2-one Formula: C20H17NO4 MolecularWeight: 335.35328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=CC3=C(C=CC(=C3)[N+](=O)[O-])C)C(=O)O2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C/C(=C\C3=C(C=CC(=C3)[N+](=O)[O-])C)/C(=O)O2)C

InChI

InChI=1S/C20H17NO4/c1-12-4-6-15(8-14(12)3)19-11-17(20(22)25-19)9-16-10-18(21(23)24)7-5-13(16)2/h4-11H,1-3H3/b17-9+