(2S)-2-(1,3-benzoxazol-2-ylamino)-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-(1,3-benzoxazol-2-ylamino)-3-phenyl-propanoic acid Openeye Name: (2S)-2-(1,3-benzoxazol-2-ylamino)-3-phenyl-propanoic acid CAS Name: (2S)-2-(1,3-benzoxazol-2-ylamino)-3-phenylpropanoic acid IUPAC Name: (2S)-2-(1,3-benzoxazol-2-ylamino)-3-phenylpropanoic acid Traditional Name: (2S)-2-(1,3-benzoxazol-2-ylamino)-3-phenyl-propionic acid Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)NC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C16H14N2O3/c19-15(20)13(10-11-6-2-1-3-7-11)18-16-17-12-8-4-5-9-14(12)21-16/h1-9,13H,10H2,(H,17,18)(H,19,20)/t13-/m0/s1