1,2-di(heptan-2-yl)-5-methyl-pyrazol-3-one

Systemtic Name: 1,2-di(heptan-2-yl)-5-methyl-pyrazol-3-one Openeye Name: 5-methyl-1,2-bis(1-methylhexyl)pyrazol-3-one CAS Name: 1,2-di(heptan-2-yl)-5-methyl-3-pyrazolone IUPAC Name: 1,2-di(heptan-2-yl)-5-methylpyrazol-3-one Traditional Name: 5-methyl-1,2-bis(1-methylhexyl)-3-pyrazolin-3-one Formula: C18H34N2O MolecularWeight: 294.47536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)N1C(=CC(=O)N1C(C)CCCCC)C

Isomeric SMILES

CCCCCC(C)N1C(=CC(=O)N1C(C)CCCCC)C

InChI

InChI=1S/C18H34N2O/c1-6-8-10-12-15(3)19-17(5)14-18(21)20(19)16(4)13-11-9-7-2/h14-16H,6-13H2,1-5H3