N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[4-(2-ethylhexoxy)phenoxy]ethanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[4-(2-ethylhexoxy)phenoxy]ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[4-(2-ethylhexoxy)phenoxy]acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[4-(2-ethylhexoxy)phenoxy]acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[4-(2-ethylhexoxy)phenoxy]acetamide Traditional Name: 2-[4-(2-ethylhexoxy)phenoxy]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide Formula: C27H35N3O4 MolecularWeight: 465.5845

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC1=CC=C(C=C1)OCC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CCCCC(CC)COC1=CC=C(C=C1)OCC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C27H35N3O4/c1-5-7-11-21(6-2)18-33-23-14-16-24(17-15-23)34-19-25(31)28-26-20(3)29(4)30(27(26)32)22-12-9-8-10-13-22/h8-10,12-17,21H,5-7,11,18-19H2,1-4H3,(H,28,31)