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

Systemtic Name: 2-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-[(3,4,5-trimethoxyphenyl)methylamino]ethanoic acid Openeye Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[(3,4,5-trimethoxyphenyl)methylamino]acetic acid CAS Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(3,4,5-trimethoxyphenyl)methylamino]acetic acid IUPAC Name: 2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-[(3,4,5-trimethoxyphenyl)methylamino]acetic acid Traditional Name: 2-(3,5-ditert-butyl-4-hydroxy-phenyl)-2-[(3,4,5-trimethoxybenzyl)amino]acetic acid Formula: C26H37NO6 MolecularWeight: 459.57508

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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)OC)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H37NO6/c1-25(2,3)17-12-16(13-18(22(17)28)26(4,5)6)21(24(29)30)27-14-15-10-19(31-7)23(33-9)20(11-15)32-8/h10-13,21,27-28H,14H2,1-9H3,(H,29,30)