7-(3,5-dimethyl-1,2-oxazol-4-yl)-5-oxidanylidene-heptanoic acid

Systemtic Name: 7-(3,5-dimethyl-1,2-oxazol-4-yl)-5-oxidanylidene-heptanoic acid Openeye Name: 7-(3,5-dimethylisoxazol-4-yl)-5-oxo-heptanoic acid CAS Name: 7-(3,5-dimethyl-4-isoxazolyl)-5-oxoheptanoic acid IUPAC Name: 7-(3,5-dimethyl-1,2-oxazol-4-yl)-5-oxoheptanoic acid Traditional Name: 7-(3,5-dimethylisoxazol-4-yl)-5-keto-enanthic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)CCCC(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)CCCC(=O)O

InChI

InChI=1S/C12H17NO4/c1-8-11(9(2)17-13-8)7-6-10(14)4-3-5-12(15)16/h3-7H2,1-2H3,(H,15,16)