2-azanyl-3-(2-butyl-4-oxidanyl-phenyl)propanoic acid

Systemtic Name: 2-azanyl-3-(2-butyl-4-oxidanyl-phenyl)propanoic acid Openeye Name: 2-amino-3-(2-butyl-4-hydroxy-phenyl)propanoic acid CAS Name: 2-amino-3-(2-butyl-4-hydroxyphenyl)propanoic acid IUPAC Name: 2-amino-3-(2-butyl-4-hydroxyphenyl)propanoic acid Traditional Name: 2-amino-3-(2-butyl-4-hydroxy-phenyl)propionic acid Formula: C13H19NO3 MolecularWeight: 237.29486

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1)O)CC(C(=O)O)N

Isomeric SMILES

CCCCC1=C(C=CC(=C1)O)CC(C(=O)O)N

InChI

InChI=1S/C13H19NO3/c1-2-3-4-9-7-11(15)6-5-10(9)8-12(14)13(16)17/h5-7,12,15H,2-4,8,14H2,1H3,(H,16,17)