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

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[(4-dimethylaminophenyl)methylamino]ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[(4-dimethylaminophenyl)methylamino]acetic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(4-dimethylaminophenyl)methylamino]acetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(4-dimethylaminophenyl)methylamino]acetic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[[4-(dimethylamino)benzyl]amino]acetic acid Formula: C25H36N2O3 MolecularWeight: 412.56494

Click to see the large picture

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)N(C)C

Isomeric SMILES

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

InChI

InChI=1S/C25H36N2O3/c1-24(2,3)19-13-17(14-20(22(19)28)25(4,5)6)21(23(29)30)26-15-16-9-11-18(12-10-16)27(7)8/h9-14,21,26,28H,15H2,1-8H3,(H,29,30)