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

Systemtic Name: 2-[(3-chlorophenyl)methylamino]-2-(3,5-ditert-butyl-4-oxidanyl-phenyl)ethanoic acid Openeye Name: 2-[(3-chlorophenyl)methylamino]-2-(3,5-ditert-butyl-4-hydroxy-phenyl)acetic acid CAS Name: 2-[(3-chlorophenyl)methylamino]-2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid IUPAC Name: 2-[(3-chlorophenyl)methylamino]-2-(3,5-ditert-butyl-4-hydroxyphenyl)acetic acid Traditional Name: 2-[(3-chlorobenzyl)amino]-2-(3,5-ditert-butyl-4-hydroxy-phenyl)acetic acid Formula: C23H30ClNO3 MolecularWeight: 403.9422

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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(=CC=C2)Cl

Isomeric SMILES

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

InChI

InChI=1S/C23H30ClNO3/c1-22(2,3)17-11-15(12-18(20(17)26)23(4,5)6)19(21(27)28)25-13-14-8-7-9-16(24)10-14/h7-12,19,25-26H,13H2,1-6H3,(H,27,28)