(2Z)-2,6-bis[(1,3-diphenylpyrazol-4-yl)methylidene]-4-methyl-cyclohexan-1-one

Systemtic Name: (2Z)-2,6-bis[(1,3-diphenylpyrazol-4-yl)methylidene]-4-methyl-cyclohexan-1-one Openeye Name: (2Z)-2,6-bis[(1,3-diphenylpyrazol-4-yl)methylene]-4-methyl-cyclohexanone CAS Name: (2Z)-2,6-bis[(1,3-diphenyl-4-pyrazolyl)methylidene]-4-methyl-1-cyclohexanone IUPAC Name: (2Z)-2,6-bis[(1,3-diphenylpyrazol-4-yl)methylidene]-4-methylcyclohexan-1-one Traditional Name: (2Z)-2,6-bis[(1,3-diphenylpyrazol-4-yl)methylene]-4-methyl-cyclohexanone Formula: C39H32N4O MolecularWeight: 572.69758

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)C(=CC5=CN(N=C5C6=CC=CC=C6)C7=CC=CC=C7)C1

Isomeric SMILES

CC1CC(=CC2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)C(=O)/C(=C\C5=CN(N=C5C6=CC=CC=C6)C7=CC=CC=C7)/C1

InChI

InChI=1S/C39H32N4O/c1-28-22-31(24-33-26-42(35-18-10-4-11-19-35)40-37(33)29-14-6-2-7-15-29)39(44)32(23-28)25-34-27-43(36-20-12-5-13-21-36)41-38(34)30-16-8-3-9-17-30/h2-21,24-28H,22-23H2,1H3/b31-24-,32-25?