2-azanyl-3-[2-(1,3-benzoxazol-4-yl)-3-methyl-phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[2-(1,3-benzoxazol-4-yl)-3-methyl-phenyl]propanoic acid Openeye Name: 2-amino-3-[2-(1,3-benzoxazol-4-yl)-3-methyl-phenyl]propanoic acid CAS Name: 2-amino-3-[2-(1,3-benzoxazol-4-yl)-3-methylphenyl]propanoic acid IUPAC Name: 2-amino-3-[2-(1,3-benzoxazol-4-yl)-3-methylphenyl]propanoic acid Traditional Name: 2-amino-3-[2-(1,3-benzoxazol-4-yl)-3-methyl-phenyl]propionic acid Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)CC(C(=O)O)N)C2=C3C(=CC=C2)OC=N3

Isomeric SMILES

CC1=C(C(=CC=C1)CC(C(=O)O)N)C2=C3C(=CC=C2)OC=N3

InChI

InChI=1S/C17H16N2O3/c1-10-4-2-5-11(8-13(18)17(20)21)15(10)12-6-3-7-14-16(12)19-9-22-14/h2-7,9,13H,8,18H2,1H3,(H,20,21)