(4E)-5-tert-butyl-2-phenyl-4-[(E)-3-phenylprop-2-enylidene]pyrazol-3-one

Systemtic Name: (4E)-5-tert-butyl-2-phenyl-4-[(E)-3-phenylprop-2-enylidene]pyrazol-3-one Openeye Name: (4E)-5-tert-butyl-2-phenyl-4-[(E)-3-phenylprop-2-enylidene]pyrazol-3-one CAS Name: (4E)-5-tert-butyl-2-phenyl-4-[(E)-3-phenylprop-2-enylidene]-3-pyrazolone IUPAC Name: (4E)-5-tert-butyl-2-phenyl-4-[(E)-3-phenylprop-2-enylidene]pyrazol-3-one Traditional Name: (4E)-5-tert-butyl-2-phenyl-4-[(E)-3-phenylprop-2-enylidene]-2-pyrazolin-3-one Formula: C22H22N2O MolecularWeight: 330.42288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=O)C1=CC=CC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C\1=NN(C(=O)/C1=C/C=C/C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2O/c1-22(2,3)20-19(16-10-13-17-11-6-4-7-12-17)21(25)24(23-20)18-14-8-5-9-15-18/h4-16H,1-3H3/b13-10+,19-16+