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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C(=O)CCCCC(=O)C2C(=NN(C2=O)C3=CC=CC=C3)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=O)[C@H]1C(=O)CCCCC(=O)[C@H]2C(=NN(C2=O)C3=CC=CC=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O4/c1-17-23(25(33)29(27-17)19-11-5-3-6-12-19)21(31)15-9-10-16-22(32)24-18(2)28-30(26(24)34)20-13-7-4-8-14-20/h3-8,11-14,23-24H,9-10,15-16H2,1-2H3/t23-,24-/m1/s1