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

Systemtic Name: 2-hexyl-4-[4-[(2-hexyl-5-methyl-3-oxidanylidene-1H-pyrazol-4-yl)carbonyl]phenyl]carbonyl-5-methyl-1H-pyrazol-3-one Openeye Name: 2-hexyl-4-[4-(2-hexyl-5-methyl-3-oxo-1H-pyrazole-4-carbonyl)benzoyl]-5-methyl-1H-pyrazol-3-one CAS Name: 2-hexyl-4-[[4-[(2-hexyl-5-methyl-3-oxo-1H-pyrazol-4-yl)-oxomethyl]phenyl]-oxomethyl]-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-hexyl-4-[4-(2-hexyl-5-methyl-3-oxo-1H-pyrazole-4-carbonyl)benzoyl]-5-methyl-1H-pyrazol-3-one Traditional Name: 2-hexyl-4-[4-(1-hexyl-5-keto-3-methyl-3-pyrazoline-4-carbonyl)benzoyl]-5-methyl-3-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)C3=C(NN(C3=O)CCCCCC)C

Isomeric SMILES

CCCCCCN1C(=O)C(=C(N1)C)C(=O)C2=CC=C(C=C2)C(=O)C3=C(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/h13-16,29-30H,5-12,17-18H2,1-4H3