3-[3-(4-chlorophenyl)-5-methyl-4H-1,2-oxazol-5-yl]-6-oxidanylidene-heptanoic acid

Systemtic Name: 3-[3-(4-chlorophenyl)-5-methyl-4H-1,2-oxazol-5-yl]-6-oxidanylidene-heptanoic acid Openeye Name: 3-[3-(4-chlorophenyl)-5-methyl-4H-isoxazol-5-yl]-6-oxo-heptanoic acid CAS Name: 3-[3-(4-chlorophenyl)-5-methyl-4H-isoxazol-5-yl]-6-oxoheptanoic acid IUPAC Name: 3-[3-(4-chlorophenyl)-5-methyl-4H-1,2-oxazol-5-yl]-6-oxoheptanoic acid Traditional Name: 3-[3-(4-chlorophenyl)-5-methyl-2-isoxazolin-5-yl]-6-keto-enanthic acid Formula: C17H20ClNO4 MolecularWeight: 337.798

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(CC(=O)O)C1(CC(=NO1)C2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC(=O)CCC(CC(=O)O)C1(CC(=NO1)C2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C17H20ClNO4/c1-11(20)3-6-13(9-16(21)22)17(2)10-15(19-23-17)12-4-7-14(18)8-5-12/h4-5,7-8,13H,3,6,9-10H2,1-2H3,(H,21,22)