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

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[(2,4-dichlorophenyl)methylamino]ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[(2,4-dichlorophenyl)methylamino]acetic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(2,4-dichlorophenyl)methylamino]acetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(2,4-dichlorophenyl)methylamino]acetic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[(2,4-dichlorobenzyl)amino]acetic acid Formula: C23H29Cl2NO3 MolecularWeight: 438.38726

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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=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H29Cl2NO3/c1-22(2,3)16-9-14(10-17(20(16)27)23(4,5)6)19(21(28)29)26-12-13-7-8-15(24)11-18(13)25/h7-11,19,26-27H,12H2,1-6H3,(H,28,29)