4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-phenyl-5-propyl-pyrazol-3-one

Systemtic Name: 4-(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-phenyl-5-propyl-pyrazol-3-one Openeye Name: 4-(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-phenyl-5-propyl-pyrazol-3-one CAS Name: 4-(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-2-phenyl-5-propyl-3-pyrazolone IUPAC Name: 4-(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-2-phenyl-5-propylpyrazol-3-one Traditional Name: 4-(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-2-phenyl-5-propyl-2-pyrazolin-3-one Formula: C26H32N2O2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CCCC1=NN(C(=O)C1=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C26H32N2O2/c1-8-12-21-22(24(30)28(27-21)18-13-10-9-11-14-18)17-15-19(25(2,3)4)23(29)20(16-17)26(5,6)7/h9-11,13-16H,8,12H2,1-7H3