(2E,6E)-2,6-bis[(2-methylpyrazol-3-yl)methylidene]cyclohexan-1-one

Systemtic Name: (2E,6E)-2,6-bis[(2-methylpyrazol-3-yl)methylidene]cyclohexan-1-one Openeye Name: (2E,6E)-2,6-bis[(2-methylpyrazol-3-yl)methylene]cyclohexanone CAS Name: (2E,6E)-2,6-bis[(2-methyl-3-pyrazolyl)methylidene]-1-cyclohexanone IUPAC Name: (2E,6E)-2,6-bis[(2-methylpyrazol-3-yl)methylidene]cyclohexan-1-one Traditional Name: (2E,6E)-2,6-bis[(2-methylpyrazol-3-yl)methylene]cyclohexanone Formula: C16H18N4O MolecularWeight: 282.34032

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C=C2CCCC(=CC3=CC=NN3C)C2=O

Isomeric SMILES

CN1N=CC=C1/C=C\2/C(=O)/C(=C/C3=CC=NN3C)/CCC2

InChI

InChI=1S/C16H18N4O/c1-19-14(6-8-17-19)10-12-4-3-5-13(16(12)21)11-15-7-9-18-20(15)2/h6-11H,3-5H2,1-2H3/b12-10+,13-11+