2-[4-[1-azanyl-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-oxidanylidene-butyl]phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[1-azanyl-4-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-oxidanylidene-butyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[1-amino-4-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-oxo-butyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[1-amino-4-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxobutyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[1-amino-4-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxobutyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[1-amino-4-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-keto-butyl]phenoxy]-2-methyl-propionic acid Formula: C28H39NO5 MolecularWeight: 469.61296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)C(C2=CC=C(C=C2)OC(C)(C)C(=O)O)N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CCC(=O)C(C2=CC=C(C=C2)OC(C)(C)C(=O)O)N

InChI

InChI=1S/C28H39NO5/c1-26(2,3)20-15-17(16-21(24(20)31)27(4,5)6)9-14-22(30)23(29)18-10-12-19(13-11-18)34-28(7,8)25(32)33/h10-13,15-16,23,31H,9,14,29H2,1-8H3,(H,32,33)