3-[[5-(2,4,6-trimethylphenyl)-1,2-oxazol-3-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[5-(2,4,6-trimethylphenyl)-1,2-oxazol-3-yl]carbonylamino]propanoic acid Openeye Name: 3-[[5-(2,4,6-trimethylphenyl)isoxazole-3-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-[5-(2,4,6-trimethylphenyl)-3-isoxazolyl]methyl]amino]propanoic acid IUPAC Name: 3-[[5-(2,4,6-trimethylphenyl)-1,2-oxazole-3-carbonyl]amino]propanoic acid Traditional Name: 3-[(5-mesitylisoxazole-3-carbonyl)amino]propionic acid Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4/c1-9-6-10(2)15(11(3)7-9)13-8-12(18-22-13)16(21)17-5-4-14(19)20/h6-8H,4-5H2,1-3H3,(H,17,21)(H,19,20)