(E)-1-(3,5-dimethylphenyl)-2-(1H-imidazol-5-yl)but-2-en-1-one

Systemtic Name: (E)-1-(3,5-dimethylphenyl)-2-(1H-imidazol-5-yl)but-2-en-1-one Openeye Name: (E)-1-(3,5-dimethylphenyl)-2-(1H-imidazol-5-yl)but-2-en-1-one CAS Name: (E)-1-(3,5-dimethylphenyl)-2-(1H-imidazol-5-yl)-2-buten-1-one IUPAC Name: (E)-1-(3,5-dimethylphenyl)-2-(1H-imidazol-5-yl)but-2-en-1-one Traditional Name: (E)-1-(3,5-dimethylphenyl)-2-(1H-imidazol-5-yl)but-2-en-1-one Formula: C15H16N2O MolecularWeight: 240.30034

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C1=CN=CN1)C(=O)C2=CC(=CC(=C2)C)C

Isomeric SMILES

C/C=C(\C1=CN=CN1)/C(=O)C2=CC(=CC(=C2)C)C

InChI

InChI=1S/C15H16N2O/c1-4-13(14-8-16-9-17-14)15(18)12-6-10(2)5-11(3)7-12/h4-9H,1-3H3,(H,16,17)/b13-4+