(2E,4E)-2-(1,3-benzodioxol-5-ylcarbonyl)-4-methyl-5-phenyl-penta-2,4-dienenitrile

Systemtic Name: (2E,4E)-2-(1,3-benzodioxol-5-ylcarbonyl)-4-methyl-5-phenyl-penta-2,4-dienenitrile Openeye Name: (2E,4E)-2-(1,3-benzodioxole-5-carbonyl)-4-methyl-5-phenyl-penta-2,4-dienenitrile CAS Name: (2E,4E)-2-[1,3-benzodioxol-5-yl(oxo)methyl]-4-methyl-5-phenylpenta-2,4-dienenitrile IUPAC Name: (2E,4E)-2-(1,3-benzodioxole-5-carbonyl)-4-methyl-5-phenylpenta-2,4-dienenitrile Traditional Name: (2E,4E)-4-methyl-5-phenyl-2-piperonyloyl-penta-2,4-dienenitrile Formula: C20H15NO3 MolecularWeight: 317.338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=CC=CC=C1)C=C(C#N)C(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

C/C(=C\C1=CC=CC=C1)/C=C(\C#N)/C(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C20H15NO3/c1-14(9-15-5-3-2-4-6-15)10-17(12-21)20(22)16-7-8-18-19(11-16)24-13-23-18/h2-11H,13H2,1H3/b14-9+,17-10+