2-(4-chlorophenyl)-3-(3-methyl-4-nitro-1,2-oxazol-5-yl)propanoic acid

Systemtic Name: 2-(4-chlorophenyl)-3-(3-methyl-4-nitro-1,2-oxazol-5-yl)propanoic acid Openeye Name: 2-(4-chlorophenyl)-3-(3-methyl-4-nitro-isoxazol-5-yl)propanoic acid CAS Name: 2-(4-chlorophenyl)-3-(3-methyl-4-nitro-5-isoxazolyl)propanoic acid IUPAC Name: 2-(4-chlorophenyl)-3-(3-methyl-4-nitro-1,2-oxazol-5-yl)propanoic acid Traditional Name: 2-(4-chlorophenyl)-3-(3-methyl-4-nitro-isoxazol-5-yl)propionic acid Formula: C13H11ClN2O5 MolecularWeight: 310.68984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])CC(C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])CC(C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C13H11ClN2O5/c1-7-12(16(19)20)11(21-15-7)6-10(13(17)18)8-2-4-9(14)5-3-8/h2-5,10H,6H2,1H3,(H,17,18)