3-[[5-(3-methylphenyl)-1,2-oxazol-3-yl]carbonyl-(2-methylpropyl)amino]propanoic acid

Systemtic Name: 3-[[5-(3-methylphenyl)-1,2-oxazol-3-yl]carbonyl-(2-methylpropyl)amino]propanoic acid Openeye Name: 3-[isobutyl-[5-(m-tolyl)isoxazole-3-carbonyl]amino]propanoic acid CAS Name: 3-[[[5-(3-methylphenyl)-3-isoxazolyl]-oxomethyl]-(2-methylpropyl)amino]propanoic acid IUPAC Name: 3-[[5-(3-methylphenyl)-1,2-oxazole-3-carbonyl]-(2-methylpropyl)amino]propanoic acid Traditional Name: 3-[isobutyl-[5-(m-tolyl)isoxazole-3-carbonyl]amino]propionic acid Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=CC(=NO2)C(=O)N(CCC(=O)O)CC(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=CC(=NO2)C(=O)N(CCC(=O)O)CC(C)C

InChI

InChI=1S/C18H22N2O4/c1-12(2)11-20(8-7-17(21)22)18(23)15-10-16(24-19-15)14-6-4-5-13(3)9-14/h4-6,9-10,12H,7-8,11H2,1-3H3,(H,21,22)