2-(4-chlorophenyl)-5-(4-hydroxyphenyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one

Systemtic Name: 2-(4-chlorophenyl)-5-(4-hydroxyphenyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one Openeye Name: 2-(4-chlorophenyl)-5-(4-hydroxyphenyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one CAS Name: 2-(4-chlorophenyl)-5-(4-hydroxyphenyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one IUPAC Name: 2-(4-chlorophenyl)-5-(4-hydroxyphenyl)-4-[(4-phenylphenyl)methyl]-1H-pyrazol-3-one Traditional Name: 2-(4-chlorophenyl)-5-(4-hydroxyphenyl)-4-(4-phenylbenzyl)-3-pyrazolin-3-one Formula: C28H21ClN2O2 MolecularWeight: 452.93154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)CC3=C(NN(C3=O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)CC3=C(NN(C3=O)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)O

InChI

InChI=1S/C28H21ClN2O2/c29-23-12-14-24(15-13-23)31-28(33)26(27(30-31)22-10-16-25(32)17-11-22)18-19-6-8-21(9-7-19)20-4-2-1-3-5-20/h1-17,30,32H,18H2