2-azanyl-3-(2,5-dimethyl-4-oxidanyl-phenyl)propanoic acid hydrochloride

Systemtic Name: 2-azanyl-3-(2,5-dimethyl-4-oxidanyl-phenyl)propanoic acid hydrochloride Openeye Name: 2-amino-3-(4-hydroxy-2,5-dimethyl-phenyl)propanoic acid hydrochloride CAS Name: 2-amino-3-(4-hydroxy-2,5-dimethylphenyl)propanoic acid hydrochloride IUPAC Name: 2-amino-3-(4-hydroxy-2,5-dimethylphenyl)propanoic acid hydrochloride Traditional Name: 2-amino-3-(4-hydroxy-2,5-dimethyl-phenyl)propionic acid hydrochloride Formula: C11H16ClNO3 MolecularWeight: 245.70264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO3.ClH/c1-6-4-10(13)7(2)3-8(6)5-9(12)11(14)15;/h3-4,9,13H,5,12H2,1-2H3,(H,14,15);1H