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

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[(3,5-ditert-butyl-4-oxidanyl-phenyl)methylamino]ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[(3,5-ditert-butyl-4-hydroxy-phenyl)methylamino]acetic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylamino]acetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(3,5-ditert-butyl-4-hydroxyphenyl)methylamino]acetic acid Traditional Name: 2-[(3,5-ditert-butyl-4-hydroxy-benzyl)amino]-2-(3,5-ditert-butyl-4-hydroxy-phenyl)acetic acid Formula: C31H47NO4 MolecularWeight: 497.70918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CNC(C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CNC(C2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C)C(=O)O

InChI

InChI=1S/C31H47NO4/c1-28(2,3)20-13-18(14-21(25(20)33)29(4,5)6)17-32-24(27(35)36)19-15-22(30(7,8)9)26(34)23(16-19)31(10,11)12/h13-16,24,32-34H,17H2,1-12H3,(H,35,36)