3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-(3,5-ditert-butyl-4-oxidanyl-phenyl)-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)propanoic acid CAS Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-(3,5-ditert-butyl-4-hydroxy-phenyl)propionic acid Formula: C25H33NO5 MolecularWeight: 427.53322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CC(C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C25H33NO5/c1-24(2,3)18-12-17(13-19(21(18)27)25(4,5)6)14-20(22(28)29)26-23(30)31-15-16-10-8-7-9-11-16/h7-13,20,27H,14-15H2,1-6H3,(H,26,30)(H,28,29)