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

Systemtic Name: 2-(3-tert-butyl-4-oxidanyl-phenoxy)-N-[4-chloranyl-3-[(2-chloranyl-4,6-dimethyl-phenyl)-(5-oxidanylidene-1,4-dihydropyrazol-3-yl)amino]phenyl]tetradecanamide Openeye Name: 2-(3-tert-butyl-4-hydroxy-phenoxy)-N-[4-chloro-3-(2-chloro-4,6-dimethyl-N-(5-oxo-1,4-dihydropyrazol-3-yl)anilino)phenyl]tetradecanamide CAS Name: 2-(3-tert-butyl-4-hydroxyphenoxy)-N-[4-chloro-3-(2-chloro-4,6-dimethyl-N-(5-oxo-1,4-dihydropyrazol-3-yl)anilino)phenyl]tetradecanamide IUPAC Name: 2-(3-tert-butyl-4-hydroxyphenoxy)-N-[4-chloro-3-(2-chloro-4,6-dimethyl-N-(5-oxo-1,4-dihydropyrazol-3-yl)anilino)phenyl]tetradecanamide Traditional Name: 2-(3-tert-butyl-4-hydroxy-phenoxy)-N-[4-chloro-3-(2-chloro-N-(5-keto-2-pyrazolin-3-yl)-4,6-dimethyl-anilino)phenyl]myristamide Formula: C41H54Cl2N4O4 MolecularWeight: 737.79786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C(=O)NC1=CC(=C(C=C1)Cl)N(C2=NNC(=O)C2)C3=C(C=C(C=C3Cl)C)C)OC4=CC(=C(C=C4)O)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC(C(=O)NC1=CC(=C(C=C1)Cl)N(C2=NNC(=O)C2)C3=C(C=C(C=C3Cl)C)C)OC4=CC(=C(C=C4)O)C(C)(C)C

InChI

InChI=1S/C41H54Cl2N4O4/c1-7-8-9-10-11-12-13-14-15-16-17-36(51-30-19-21-35(48)31(25-30)41(4,5)6)40(50)44-29-18-20-32(42)34(24-29)47(37-26-38(49)46-45-37)39-28(3)22-27(2)23-33(39)43/h18-25,36,48H,7-17,26H2,1-6H3,(H,44,50)(H,46,49)