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

Systemtic Name: 2-hexyl-4-[(1-hexyl-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-one Openeye Name: 2-hexyl-4-[(1-hexyl-3-methyl-5-oxo-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-one CAS Name: 2-hexyl-4-[(1-hexyl-3-methyl-5-oxo-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-one IUPAC Name: 2-hexyl-4-[(1-hexyl-3-methyl-5-oxo-4H-pyrazol-4-yl)methyl]-5-methyl-4H-pyrazol-3-one Traditional Name: 2-hexyl-4-[(1-hexyl-5-keto-3-methyl-2-pyrazolin-4-yl)methyl]-5-methyl-2-pyrazolin-3-one Formula: C21H36N4O2 MolecularWeight: 376.53614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(C(=N1)C)CC2C(=NN(C2=O)CCCCCC)C

Isomeric SMILES

CCCCCCN1C(=O)C(C(=N1)C)CC2C(=NN(C2=O)CCCCCC)C

InChI

InChI=1S/C21H36N4O2/c1-5-7-9-11-13-24-20(26)18(16(3)22-24)15-19-17(4)23-25(21(19)27)14-12-10-8-6-2/h18-19H,5-15H2,1-4H3