(4R)-2-hexyl-4-[4-[[(4R)-1-hexyl-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]carbonyl]phenyl]carbonyl-5-methyl-4H-pyrazol-3-one

Systemtic Name: (4R)-2-hexyl-4-[4-[[(4R)-1-hexyl-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl]carbonyl]phenyl]carbonyl-5-methyl-4H-pyrazol-3-one Openeye Name: (4R)-2-hexyl-4-[4-[(4R)-1-hexyl-3-methyl-5-oxo-4H-pyrazole-4-carbonyl]benzoyl]-5-methyl-4H-pyrazol-3-one CAS Name: (4R)-2-hexyl-4-[[4-[[(4R)-1-hexyl-3-methyl-5-oxo-4H-pyrazol-4-yl]-oxomethyl]phenyl]-oxomethyl]-5-methyl-4H-pyrazol-3-one IUPAC Name: (4R)-2-hexyl-4-[4-[(4R)-1-hexyl-3-methyl-5-oxo-4H-pyrazole-4-carbonyl]benzoyl]-5-methyl-4H-pyrazol-3-one Traditional Name: (4R)-2-hexyl-4-[4-[(4R)-1-hexyl-5-keto-3-methyl-2-pyrazoline-4-carbonyl]benzoyl]-5-methyl-2-pyrazolin-3-one Formula: C28H38N4O4 MolecularWeight: 494.62572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(C(=N1)C)C(=O)C2=CC=C(C=C2)C(=O)C3C(=NN(C3=O)CCCCCC)C

Isomeric SMILES

CCCCCCN1C(=O)[C@H](C(=N1)C)C(=O)C2=CC=C(C=C2)C(=O)[C@H]3C(=NN(C3=O)CCCCCC)C

InChI

InChI=1S/C28H38N4O4/c1-5-7-9-11-17-31-27(35)23(19(3)29-31)25(33)21-13-15-22(16-14-21)26(34)24-20(4)30-32(28(24)36)18-12-10-8-6-2/h13-16,23-24H,5-12,17-18H2,1-4H3/t23-,24-/m1/s1