2-azanyl-3-[2-tert-butyl-4,5-bis(oxidanyl)phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-tert-butyl-4,5-bis(oxidanyl)phenyl]propanoic acid Openeye Name: 2-amino-3-(2-tert-butyl-4,5-dihydroxy-phenyl)propanoic acid CAS Name: 2-amino-3-(2-tert-butyl-4,5-dihydroxyphenyl)propanoic acid IUPAC Name: 2-amino-3-(2-tert-butyl-4,5-dihydroxyphenyl)propanoic acid Traditional Name: 2-amino-3-(2-tert-butyl-4,5-dihydroxy-phenyl)propionic acid Formula: C13H19NO4 MolecularWeight: 253.29426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1CC(C(=O)O)N)O)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1CC(C(=O)O)N)O)O

InChI

InChI=1S/C13H19NO4/c1-13(2,3)8-6-11(16)10(15)5-7(8)4-9(14)12(17)18/h5-6,9,15-16H,4,14H2,1-3H3,(H,17,18)