1-[4-(5-methyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-2-[2-(phenylmethyl)phenoxy]ethanone

Systemtic Name: 1-[4-(5-methyl-2-oxidanyl-phenyl)carbonylpyrazol-1-yl]-2-[2-(phenylmethyl)phenoxy]ethanone Openeye Name: 2-(2-benzylphenoxy)-1-[4-(2-hydroxy-5-methyl-benzoyl)pyrazol-1-yl]ethanone CAS Name: 1-[4-[(2-hydroxy-5-methylphenyl)-oxomethyl]-1-pyrazolyl]-2-[2-(phenylmethyl)phenoxy]ethanone IUPAC Name: 2-(2-benzylphenoxy)-1-[4-(2-hydroxy-5-methylbenzoyl)pyrazol-1-yl]ethanone Traditional Name: 2-(2-benzylphenoxy)-1-[4-(2-hydroxy-5-methyl-benzoyl)pyrazol-1-yl]ethanone Formula: C26H22N2O4 MolecularWeight: 426.46388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)C2=CN(N=C2)C(=O)COC3=CC=CC=C3CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)C2=CN(N=C2)C(=O)COC3=CC=CC=C3CC4=CC=CC=C4

InChI

InChI=1S/C26H22N2O4/c1-18-11-12-23(29)22(13-18)26(31)21-15-27-28(16-21)25(30)17-32-24-10-6-5-9-20(24)14-19-7-3-2-4-8-19/h2-13,15-16,29H,14,17H2,1H3