ethyl 3-[3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-5-oxidanyl-phenyl]carbonylamino]phenyl]butanoate

Systemtic Name: ethyl 3-[3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-5-oxidanyl-phenyl]carbonylamino]phenyl]butanoate Openeye Name: ethyl 3-[3-[[2-[2,4-bis(1,1-dimethylpropyl)phenoxy]-5-hydroxy-benzoyl]amino]phenyl]butanoate CAS Name: 3-[3-[[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-5-hydroxyphenyl]-oxomethyl]amino]phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 3-[3-[[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-5-hydroxybenzoyl]amino]phenyl]butanoate Traditional Name: 3-[3-[[2-(2,4-ditert-amylphenoxy)-5-hydroxy-benzoyl]amino]phenyl]butyric acid ethyl ester Formula: C35H45NO5 MolecularWeight: 559.7355

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)O)C(=O)NC3=CC=CC(=C3)C(C)CC(=O)OCC)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)O)C(=O)NC3=CC=CC(=C3)C(C)CC(=O)OCC)C(C)(C)CC

InChI

InChI=1S/C35H45NO5/c1-9-34(5,6)25-15-17-31(29(21-25)35(7,8)10-2)41-30-18-16-27(37)22-28(30)33(39)36-26-14-12-13-24(20-26)23(4)19-32(38)40-11-3/h12-18,20-23,37H,9-11,19H2,1-8H3,(H,36,39)