2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[(3,4-dimethoxy-5-oxidanyl-phenyl)methylamino]ethanoic acid

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[(3,4-dimethoxy-5-oxidanyl-phenyl)methylamino]ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[(3-hydroxy-4,5-dimethoxy-phenyl)methylamino]acetic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(3-hydroxy-4,5-dimethoxyphenyl)methylamino]acetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(3-hydroxy-4,5-dimethoxyphenyl)methylamino]acetic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[(3-hydroxy-4,5-dimethoxy-benzyl)amino]acetic acid Formula: C25H35NO6 MolecularWeight: 445.5485

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C(=O)O)NCC2=CC(=C(C(=C2)OC)OC)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(C(=O)O)NCC2=CC(=C(C(=C2)OC)OC)O

InChI

InChI=1S/C25H35NO6/c1-24(2,3)16-11-15(12-17(21(16)28)25(4,5)6)20(23(29)30)26-13-14-9-18(27)22(32-8)19(10-14)31-7/h9-12,20,26-28H,13H2,1-8H3,(H,29,30)