2-[(E)-2-(1,5-dimethylpyrazol-4-yl)ethenyl]-6-methyl-pyran-4-one

Systemtic Name: 2-[(E)-2-(1,5-dimethylpyrazol-4-yl)ethenyl]-6-methyl-pyran-4-one Openeye Name: 2-[(E)-2-(1,5-dimethylpyrazol-4-yl)vinyl]-6-methyl-pyran-4-one CAS Name: 2-[(E)-2-(1,5-dimethyl-4-pyrazolyl)ethenyl]-6-methyl-4-pyranone IUPAC Name: 2-[(E)-2-(1,5-dimethylpyrazol-4-yl)ethenyl]-6-methylpyran-4-one Traditional Name: 2-[(E)-2-(1,5-dimethylpyrazol-4-yl)vinyl]-6-methyl-pyran-4-one Formula: C13H14N2O2 MolecularWeight: 230.26246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C=C(O1)C=CC2=C(N(N=C2)C)C

Isomeric SMILES

CC1=CC(=O)C=C(O1)/C=C/C2=C(N(N=C2)C)C

InChI

InChI=1S/C13H14N2O2/c1-9-6-12(16)7-13(17-9)5-4-11-8-14-15(3)10(11)2/h4-8H,1-3H3/b5-4+