3-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]carbonylamino]propanoic acid Openeye Name: 3-[[5-(p-tolyl)isoxazole-3-carbonyl]amino]propanoic acid CAS Name: 3-[[[5-(4-methylphenyl)-3-isoxazolyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[5-(4-methylphenyl)-1,2-oxazole-3-carbonyl]amino]propanoic acid Traditional Name: 3-[[5-(p-tolyl)isoxazole-3-carbonyl]amino]propionic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NCCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)C(=O)NCCC(=O)O

InChI

InChI=1S/C14H14N2O4/c1-9-2-4-10(5-3-9)12-8-11(16-20-12)14(19)15-7-6-13(17)18/h2-5,8H,6-7H2,1H3,(H,15,19)(H,17,18)