5-(4-octoxyphenyl)-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-(4-octoxyphenyl)-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-(4-octoxyphenyl)-2-phenyl-4H-pyrazol-3-one CAS Name: 5-(4-octoxyphenyl)-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-(4-octoxyphenyl)-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-(4-octoxyphenyl)-2-phenyl-2-pyrazolin-3-one Formula: C23H28N2O2 MolecularWeight: 364.48062

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=NN(C(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=NN(C(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C23H28N2O2/c1-2-3-4-5-6-10-17-27-21-15-13-19(14-16-21)22-18-23(26)25(24-22)20-11-8-7-9-12-20/h7-9,11-16H,2-6,10,17-18H2,1H3