3-azanyl-3-[4-(2-methylpropyl)phenyl]propanoic acid

Systemtic Name: 3-azanyl-3-[4-(2-methylpropyl)phenyl]propanoic acid Openeye Name: 3-amino-3-(4-isobutylphenyl)propanoic acid CAS Name: 3-amino-3-[4-(2-methylpropyl)phenyl]propanoic acid IUPAC Name: 3-amino-3-[4-(2-methylpropyl)phenyl]propanoic acid Traditional Name: 3-amino-3-(4-isobutylphenyl)propionic acid Formula: C13H19NO2 MolecularWeight: 221.29546

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2/c1-9(2)7-10-3-5-11(6-4-10)12(14)8-13(15)16/h3-6,9,12H,7-8,14H2,1-2H3,(H,15,16)