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

Systemtic Name: 3-(3-chlorophenyl)-4-(3-methyl-4-nitro-1,2-oxazol-5-yl)butanoic acid Openeye Name: 3-(3-chlorophenyl)-4-(3-methyl-4-nitro-isoxazol-5-yl)butanoic acid CAS Name: 3-(3-chlorophenyl)-4-(3-methyl-4-nitro-5-isoxazolyl)butanoic acid IUPAC Name: 3-(3-chlorophenyl)-4-(3-methyl-4-nitro-1,2-oxazol-5-yl)butanoic acid Traditional Name: 3-(3-chlorophenyl)-4-(3-methyl-4-nitro-isoxazol-5-yl)butyric acid Formula: C14H13ClN2O5 MolecularWeight: 324.71642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN2O5/c1-8-14(17(20)21)12(22-16-8)6-10(7-13(18)19)9-3-2-4-11(15)5-9/h2-5,10H,6-7H2,1H3,(H,18,19)