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

Systemtic Name: 2-azanyl-3-[4,5-bis(oxidanyl)-2-propan-2-yl-phenyl]propanoic acid Openeye Name: 2-amino-3-(4,5-dihydroxy-2-isopropyl-phenyl)propanoic acid CAS Name: 2-amino-3-(4,5-dihydroxy-2-propan-2-ylphenyl)propanoic acid IUPAC Name: 2-amino-3-(4,5-dihydroxy-2-propan-2-ylphenyl)propanoic acid Traditional Name: 2-amino-3-(4,5-dihydroxy-2-isopropyl-phenyl)propionic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4/c1-6(2)8-5-11(15)10(14)4-7(8)3-9(13)12(16)17/h4-6,9,14-15H,3,13H2,1-2H3,(H,16,17)