2-azanyl-3-(3-ethanoyl-2-methyl-4-oxidanyl-phenyl)propanoic acid

Systemtic Name: 2-azanyl-3-(3-ethanoyl-2-methyl-4-oxidanyl-phenyl)propanoic acid Openeye Name: 3-(3-acetyl-4-hydroxy-2-methyl-phenyl)-2-amino-propanoic acid CAS Name: 3-(3-acetyl-4-hydroxy-2-methylphenyl)-2-aminopropanoic acid IUPAC Name: 3-(3-acetyl-4-hydroxy-2-methylphenyl)-2-aminopropanoic acid Traditional Name: 3-(3-acetyl-4-hydroxy-2-methyl-phenyl)-2-amino-propionic acid Formula: C12H15NO4 MolecularWeight: 237.2518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C(=O)C)O)CC(C(=O)O)N

Isomeric SMILES

CC1=C(C=CC(=C1C(=O)C)O)CC(C(=O)O)N

InChI

InChI=1S/C12H15NO4/c1-6-8(5-9(13)12(16)17)3-4-10(15)11(6)7(2)14/h3-4,9,15H,5,13H2,1-2H3,(H,16,17)