3-[2-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-4,5-bis(chloranyl)phenyl]-2-methyl-propanoic acid

Systemtic Name: 3-[2-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)-4,5-bis(chloranyl)phenyl]-2-methyl-propanoic acid Openeye Name: 3-[2-(2-amino-3-hydroxy-3-oxo-propyl)-4,5-dichloro-phenyl]-2-methyl-propanoic acid CAS Name: 3-[2-(2-amino-3-hydroxy-3-oxopropyl)-4,5-dichlorophenyl]-2-methylpropanoic acid IUPAC Name: 3-[2-(2-amino-3-hydroxy-3-oxopropyl)-4,5-dichlorophenyl]-2-methylpropanoic acid Traditional Name: 3-[2-(2-amino-3-hydroxy-3-keto-propyl)-4,5-dichloro-phenyl]-2-methyl-propionic acid Formula: C13H15Cl2NO4 MolecularWeight: 320.1685

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1CC(C(=O)O)N)Cl)Cl)C(=O)O

Isomeric SMILES

CC(CC1=CC(=C(C=C1CC(C(=O)O)N)Cl)Cl)C(=O)O

InChI

InChI=1S/C13H15Cl2NO4/c1-6(12(17)18)2-7-3-9(14)10(15)4-8(7)5-11(16)13(19)20/h3-4,6,11H,2,5,16H2,1H3,(H,17,18)(H,19,20)