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

Systemtic Name: (3E)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-propan-2-ylphenyl)furan-2-one Openeye Name: (3E)-3-(1,3-benzodioxol-5-ylmethylene)-5-(4-isopropylphenyl)furan-2-one CAS Name: (3E)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-propan-2-ylphenyl)-2-furanone IUPAC Name: (3E)-3-(1,3-benzodioxol-5-ylmethylidene)-5-(4-propan-2-ylphenyl)furan-2-one Traditional Name: (3E)-5-p-cumenyl-3-piperonylidene-furan-2-one Formula: C21H18O4 MolecularWeight: 334.36522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18O4/c1-13(2)15-4-6-16(7-5-15)19-11-17(21(22)25-19)9-14-3-8-18-20(10-14)24-12-23-18/h3-11,13H,12H2,1-2H3/b17-9+