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

Systemtic Name: 2-[(4-cyanophenyl)methylamino]-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-[(4-cyanophenyl)methylamino]-2-(3,5-ditert-butyl-4-hydroxy-phenyl)acetic acid CAS Name: 2-[(4-cyanophenyl)methylamino]-2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid IUPAC Name: 2-[(4-cyanophenyl)methylamino]-2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid Traditional Name: 2-[(4-cyanobenzyl)amino]-2-(3,5-ditert-butyl-4-hydroxy-phenyl)acetic acid Formula: C24H30N2O3 MolecularWeight: 394.5066

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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)C#N

Isomeric SMILES

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

InChI

InChI=1S/C24H30N2O3/c1-23(2,3)18-11-17(12-19(21(18)27)24(4,5)6)20(22(28)29)26-14-16-9-7-15(13-25)8-10-16/h7-12,20,26-27H,14H2,1-6H3,(H,28,29)