1,5-dimethyl-4-(1-methyl-4-bicyclo[2.2.2]octanyl)-2-phenyl-pyrazol-3-one

Systemtic Name: 1,5-dimethyl-4-(1-methyl-4-bicyclo[2.2.2]octanyl)-2-phenyl-pyrazol-3-one Openeye Name: 1,5-dimethyl-4-(1-methyl-4-bicyclo[2.2.2]octanyl)-2-phenyl-pyrazol-3-one CAS Name: 1,5-dimethyl-4-(1-methyl-4-bicyclo[2.2.2]octanyl)-2-phenyl-3-pyrazolone IUPAC Name: 1,5-dimethyl-4-(1-methyl-4-bicyclo[2.2.2]octanyl)-2-phenylpyrazol-3-one Traditional Name: 1,5-dimethyl-4-(1-methyl-4-bicyclo[2.2.2]octanyl)-2-phenyl-3-pyrazolin-3-one Formula: C20H26N2O MolecularWeight: 310.43324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C34CCC(CC3)(CC4)C

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C34CCC(CC3)(CC4)C

InChI

InChI=1S/C20H26N2O/c1-15-17(20-12-9-19(2,10-13-20)11-14-20)18(23)22(21(15)3)16-7-5-4-6-8-16/h4-8H,9-14H2,1-3H3