5-(4-pentan-2-ylphenyl)-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 5-(4-pentan-2-ylphenyl)-2-phenyl-1H-pyrazol-3-one Openeye Name: 5-[4-(1-methylbutyl)phenyl]-2-phenyl-1H-pyrazol-3-one CAS Name: 5-(4-pentan-2-ylphenyl)-2-phenyl-1H-pyrazol-3-one IUPAC Name: 5-(4-pentan-2-ylphenyl)-2-phenyl-1H-pyrazol-3-one Traditional Name: 5-[4-(1-methylbutyl)phenyl]-2-phenyl-3-pyrazolin-3-one Formula: C20H22N2O MolecularWeight: 306.40148

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC=C(C=C1)C2=CC(=O)N(N2)C3=CC=CC=C3

Isomeric SMILES

CCCC(C)C1=CC=C(C=C1)C2=CC(=O)N(N2)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O/c1-3-7-15(2)16-10-12-17(13-11-16)19-14-20(23)22(21-19)18-8-5-4-6-9-18/h4-6,8-15,21H,3,7H2,1-2H3