2-azanylpropanoic acid; 2-[4-(2-methylpropyl)phenyl]propanoic acid

Systemtic Name: 2-azanylpropanoic acid; 2-[4-(2-methylpropyl)phenyl]propanoic acid Openeye Name: 2-aminopropanoic acid; 2-(4-isobutylphenyl)propanoic acid CAS Name: 2-aminopropanoic acid; 2-[4-(2-methylpropyl)phenyl]propanoic acid IUPAC Name: 2-aminopropanoic acid; 2-[4-(2-methylpropyl)phenyl]propanoic acid Traditional Name: 2-aminopropionic acid; 2-(4-isobutylphenyl)propionic acid Formula: C16H25NO4 MolecularWeight: 295.374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.CC(C(=O)O)N

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(C)C(=O)O.CC(C(=O)O)N

InChI

InChI=1S/C13H18O2.C3H7NO2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;1-2(4)3(5)6/h4-7,9-10H,8H2,1-3H3,(H,14,15);2H,4H2,1H3,(H,5,6)