4-dodecanoyl-2,5-dimethyl-1H-pyrazol-3-one

Systemtic Name: 4-dodecanoyl-2,5-dimethyl-1H-pyrazol-3-one Openeye Name: 4-dodecanoyl-2,5-dimethyl-1H-pyrazol-3-one CAS Name: 2,5-dimethyl-4-(1-oxododecyl)-1H-pyrazol-3-one IUPAC Name: 4-dodecanoyl-2,5-dimethyl-1H-pyrazol-3-one Traditional Name: 4-lauroyl-2,5-dimethyl-3-pyrazolin-3-one Formula: C17H30N2O2 MolecularWeight: 294.4323

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=C(NN(C1=O)C)C

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=C(NN(C1=O)C)C

InChI

InChI=1S/C17H30N2O2/c1-4-5-6-7-8-9-10-11-12-13-15(20)16-14(2)18-19(3)17(16)21/h18H,4-13H2,1-3H3