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

Systemtic Name: 4-[furan-2-yl-(1-hexyl-3-methyl-5-oxidanylidene-4H-pyrazol-4-yl)methyl]-2-hexyl-5-methyl-4H-pyrazol-3-one Openeye Name: 4-[2-furyl-(1-hexyl-3-methyl-5-oxo-4H-pyrazol-4-yl)methyl]-2-hexyl-5-methyl-4H-pyrazol-3-one CAS Name: 4-[2-furanyl-(1-hexyl-3-methyl-5-oxo-4H-pyrazol-4-yl)methyl]-2-hexyl-5-methyl-4H-pyrazol-3-one IUPAC Name: 4-[furan-2-yl-(1-hexyl-3-methyl-5-oxo-4H-pyrazol-4-yl)methyl]-2-hexyl-5-methyl-4H-pyrazol-3-one Traditional Name: 4-[2-furyl-(1-hexyl-5-keto-3-methyl-2-pyrazolin-4-yl)methyl]-2-hexyl-5-methyl-2-pyrazolin-3-one Formula: C25H38N4O3 MolecularWeight: 442.59422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C(C(=N1)C)C(C2C(=NN(C2=O)CCCCCC)C)C3=CC=CO3

Isomeric SMILES

CCCCCCN1C(=O)C(C(=N1)C)C(C2C(=NN(C2=O)CCCCCC)C)C3=CC=CO3

InChI

InChI=1S/C25H38N4O3/c1-5-7-9-11-15-28-24(30)21(18(3)26-28)23(20-14-13-17-32-20)22-19(4)27-29(25(22)31)16-12-10-8-6-2/h13-14,17,21-23H,5-12,15-16H2,1-4H3