2-azanyl-3-(4-chlorophenyl)propanoic acid; 2-azanyl-3-methyl-butanoic acid

Systemtic Name: 2-azanyl-3-(4-chlorophenyl)propanoic acid; 2-azanyl-3-methyl-butanoic acid Openeye Name: 2-amino-3-(4-chlorophenyl)propanoic acid; 2-amino-3-methyl-butanoic acid CAS Name: 2-amino-3-(4-chlorophenyl)propanoic acid; 2-amino-3-methylbutanoic acid IUPAC Name: 2-amino-3-(4-chlorophenyl)propanoic acid; 2-amino-3-methylbutanoic acid Traditional Name: 2-amino-3-(4-chlorophenyl)propionic acid; 2-amino-3-methyl-butyric acid Formula: C14H21ClN2O4 MolecularWeight: 316.78054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H10ClNO2.C5H11NO2/c10-7-3-1-6(2-4-7)5-8(11)9(12)13;1-3(2)4(6)5(7)8/h1-4,8H,5,11H2,(H,12,13);3-4H,6H2,1-2H3,(H,7,8)