2-[5-(3-nitrophenyl)-1,2-oxazol-4-yl]ethanoic acid

Systemtic Name: 2-[5-(3-nitrophenyl)-1,2-oxazol-4-yl]ethanoic acid Openeye Name: 2-[5-(3-nitrophenyl)isoxazol-4-yl]acetic acid CAS Name: 2-[5-(3-nitrophenyl)-4-isoxazolyl]acetic acid IUPAC Name: 2-[5-(3-nitrophenyl)-1,2-oxazol-4-yl]acetic acid Traditional Name: 2-[5-(3-nitrophenyl)isoxazol-4-yl]acetic acid Formula: C11H8N2O5 MolecularWeight: 248.19162

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(C=NO2)CC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=C(C=NO2)CC(=O)O

InChI

InChI=1S/C11H8N2O5/c14-10(15)5-8-6-12-18-11(8)7-2-1-3-9(4-7)13(16)17/h1-4,6H,5H2,(H,14,15)