2-(3-tert-butyl-4-oxidanyl-phenoxy)-N-[2-(2-chloranyl-4,6-dimethyl-phenyl)-3-oxidanylidene-1H-pyrazol-5-yl]tetradecanamide

Systemtic Name: 2-(3-tert-butyl-4-oxidanyl-phenoxy)-N-[2-(2-chloranyl-4,6-dimethyl-phenyl)-3-oxidanylidene-1H-pyrazol-5-yl]tetradecanamide Openeye Name: 2-(3-tert-butyl-4-hydroxy-phenoxy)-N-[2-(2-chloro-4,6-dimethyl-phenyl)-3-oxo-1H-pyrazol-5-yl]tetradecanamide CAS Name: 2-(3-tert-butyl-4-hydroxyphenoxy)-N-[2-(2-chloro-4,6-dimethylphenyl)-3-oxo-1H-pyrazol-5-yl]tetradecanamide IUPAC Name: 2-(3-tert-butyl-4-hydroxyphenoxy)-N-[2-(2-chloro-4,6-dimethylphenyl)-3-oxo-1H-pyrazol-5-yl]tetradecanamide Traditional Name: 2-(3-tert-butyl-4-hydroxy-phenoxy)-N-[1-(2-chloro-4,6-dimethyl-phenyl)-5-keto-3-pyrazolin-3-yl]myristamide Formula: C35H50ClN3O4 MolecularWeight: 612.2422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)NC1=CC(=O)N(N1)C2=C(C=C(C=C2Cl)C)C)OC3=CC(=C(C=C3)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)NC1=CC(=O)N(N1)C2=C(C=C(C=C2Cl)C)C)OC3=CC(=C(C=C3)O)C(C)(C)C

InChI

InChI=1S/C35H50ClN3O4/c1-7-8-9-10-11-12-13-14-15-16-17-30(43-26-18-19-29(40)27(22-26)35(4,5)6)34(42)37-31-23-32(41)39(38-31)33-25(3)20-24(2)21-28(33)36/h18-23,30,38,40H,7-17H2,1-6H3,(H,37,42)