N-[5-oxidanylidene-1-[2,4,6-tris(chloranyl)phenyl]-4H-pyrazol-3-yl]octadecanamide

Systemtic Name: N-[5-oxidanylidene-1-[2,4,6-tris(chloranyl)phenyl]-4H-pyrazol-3-yl]octadecanamide Openeye Name: N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]octadecanamide CAS Name: N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]octadecanamide IUPAC Name: N-[5-oxo-1-(2,4,6-trichlorophenyl)-4H-pyrazol-3-yl]octadecanamide Traditional Name: N-[5-keto-1-(2,4,6-trichlorophenyl)-2-pyrazolin-3-yl]stearamide Formula: C27H40Cl3N3O2 MolecularWeight: 544.9844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC1=NN(C(=O)C1)C2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC1=NN(C(=O)C1)C2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C27H40Cl3N3O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-25(34)31-24-20-26(35)33(32-24)27-22(29)18-21(28)19-23(27)30/h18-19H,2-17,20H2,1H3,(H,31,32,34)