2-[2-(2,2-dimethylpropyl)-4-(2-methylbutan-2-yl)phenoxy]-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)ethanamide

Systemtic Name: 2-[2-(2,2-dimethylpropyl)-4-(2-methylbutan-2-yl)phenoxy]-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)ethanamide Openeye Name: 2-[4-(1,1-dimethylpropyl)-2-(2,2-dimethylpropyl)phenoxy]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)acetamide CAS Name: 2-[2-(2,2-dimethylpropyl)-4-(2-methylbutan-2-yl)phenoxy]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)acetamide IUPAC Name: 2-[2-(2,2-dimethylpropyl)-4-(2-methylbutan-2-yl)phenoxy]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)acetamide Traditional Name: 2-(4-tert-amyl-2-neopentyl-phenoxy)-N-(5-keto-1-phenyl-3-pyrazolin-3-yl)acetamide Formula: C27H35N3O3 MolecularWeight: 449.5851

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC(=O)N(N2)C3=CC=CC=C3)CC(C)(C)C

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC(=O)N(N2)C3=CC=CC=C3)CC(C)(C)C

InChI

InChI=1S/C27H35N3O3/c1-7-27(5,6)20-13-14-22(19(15-20)17-26(2,3)4)33-18-24(31)28-23-16-25(32)30(29-23)21-11-9-8-10-12-21/h8-16,29H,7,17-18H2,1-6H3,(H,28,31)