3-(5-ethoxycarbonyl-4,5-dihydro-1,2-oxazol-3-yl)benzoic acid

Systemtic Name: 3-(5-ethoxycarbonyl-4,5-dihydro-1,2-oxazol-3-yl)benzoic acid Openeye Name: 3-(5-ethoxycarbonyl-4,5-dihydroisoxazol-3-yl)benzoic acid CAS Name: 3-(5-ethoxycarbonyl-4,5-dihydroisoxazol-3-yl)benzoic acid IUPAC Name: 3-(5-ethoxycarbonyl-4,5-dihydro-1,2-oxazol-3-yl)benzoic acid Traditional Name: 3-(5-carbethoxy-2-isoxazolin-3-yl)benzoic acid Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(=NO1)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

CCOC(=O)C1CC(=NO1)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C13H13NO5/c1-2-18-13(17)11-7-10(14-19-11)8-4-3-5-9(6-8)12(15)16/h3-6,11H,2,7H2,1H3,(H,15,16)