1,6-bis(4-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)hexane-1,6-dione

Systemtic Name: 1,6-bis(4-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)hexane-1,6-dione Openeye Name: 1,6-bis(4-methyl-5-oxo-1-phenyl-4H-pyrazol-3-yl)hexane-1,6-dione CAS Name: 1,6-bis(4-methyl-5-oxo-1-phenyl-4H-pyrazol-3-yl)hexane-1,6-dione IUPAC Name: 1,6-bis(4-methyl-5-oxo-1-phenyl-4H-pyrazol-3-yl)hexane-1,6-dione Traditional Name: 1,6-bis(5-keto-4-methyl-1-phenyl-2-pyrazolin-3-yl)hexane-1,6-dione Formula: C26H26N4O4 MolecularWeight: 458.50904

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=NN(C1=O)C2=CC=CC=C2)C(=O)CCCCC(=O)C3=NN(C(=O)C3C)C4=CC=CC=C4

Isomeric SMILES

CC1C(=NN(C1=O)C2=CC=CC=C2)C(=O)CCCCC(=O)C3=NN(C(=O)C3C)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O4/c1-17-23(27-29(25(17)33)19-11-5-3-6-12-19)21(31)15-9-10-16-22(32)24-18(2)26(34)30(28-24)20-13-7-4-8-14-20/h3-8,11-14,17-18H,9-10,15-16H2,1-2H3