4-[2-(2,4-dimethylphenyl)ethyl-oxidanyl-amino]-3-oxidanyl-butanoic acid hydrochloride

Systemtic Name: 4-[2-(2,4-dimethylphenyl)ethyl-oxidanyl-amino]-3-oxidanyl-butanoic acid hydrochloride Openeye Name: 4-[2-(2,4-dimethylphenyl)ethyl-hydroxy-amino]-3-hydroxy-butanoic acid hydrochloride CAS Name: 4-[2-(2,4-dimethylphenyl)ethyl-hydroxyamino]-3-hydroxybutanoic acid hydrochloride IUPAC Name: 4-[2-(2,4-dimethylphenyl)ethyl-hydroxyamino]-3-hydroxybutanoic acid hydrochloride Traditional Name: 4-[2-(2,4-dimethylphenyl)ethyl-hydroxy-amino]-3-hydroxy-butyric acid hydrochloride Formula: C14H22ClNO4 MolecularWeight: 303.78178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCN(CC(CC(=O)O)O)O)C.Cl

Isomeric SMILES

CC1=CC(=C(C=C1)CCN(CC(CC(=O)O)O)O)C.Cl

InChI

InChI=1S/C14H21NO4.ClH/c1-10-3-4-12(11(2)7-10)5-6-15(19)9-13(16)8-14(17)18;/h3-4,7,13,16,19H,5-6,8-9H2,1-2H3,(H,17,18);1H