(3E)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-ethylphenyl)furan-2-one

Systemtic Name: (3E)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-ethylphenyl)furan-2-one Openeye Name: (3E)-3-(1,3-benzodioxol-5-ylmethylene)-5-(4-ethylphenyl)furan-2-one CAS Name: (3E)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-ethylphenyl)-2-furanone IUPAC Name: (3E)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-ethylphenyl)furan-2-one Traditional Name: (3E)-5-(4-ethylphenyl)-3-piperonylidene-furan-2-one Formula: C20H16O4 MolecularWeight: 320.33864

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC(=CC3=CC4=C(C=C3)OCO4)C(=O)O2

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C/C(=C\C3=CC4=C(C=C3)OCO4)/C(=O)O2

InChI

InChI=1S/C20H16O4/c1-2-13-3-6-15(7-4-13)18-11-16(20(21)24-18)9-14-5-8-17-19(10-14)23-12-22-17/h3-11H,2,12H2,1H3/b16-9+