5-heptadecylpyrazol-3-one

Systemtic Name: 5-heptadecylpyrazol-3-one Openeye Name: 5-heptadecylpyrazol-3-one CAS Name: 5-heptadecyl-3-pyrazolone IUPAC Name: 5-heptadecylpyrazol-3-one Traditional Name: 5-heptadecylpyrazol-3-one Formula: C20H36N2O MolecularWeight: 320.51264

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC1=CC(=O)N=N1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC1=CC(=O)N=N1

InChI

InChI=1S/C20H36N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-18-20(23)22-21-19/h18H,2-17H2,1H3