4-dodecanoyl-2-phenyl-5-propyl-1H-pyrazol-3-one

Systemtic Name: 4-dodecanoyl-2-phenyl-5-propyl-1H-pyrazol-3-one Openeye Name: 4-dodecanoyl-2-phenyl-5-propyl-1H-pyrazol-3-one CAS Name: 4-(1-oxododecyl)-2-phenyl-5-propyl-1H-pyrazol-3-one IUPAC Name: 4-dodecanoyl-2-phenyl-5-propyl-1H-pyrazol-3-one Traditional Name: 4-lauroyl-2-phenyl-5-propyl-3-pyrazolin-3-one Formula: C24H36N2O2 MolecularWeight: 384.55484

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(NN(C1=O)C2=CC=CC=C2)CCC

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(NN(C1=O)C2=CC=CC=C2)CCC

InChI

InChI=1S/C24H36N2O2/c1-3-5-6-7-8-9-10-11-15-19-22(27)23-21(16-4-2)25-26(24(23)28)20-17-13-12-14-18-20/h12-14,17-18,25H,3-11,15-16,19H2,1-2H3