4-[7-(3-methyl-1,2-oxazol-5-yl)heptoxy]benzoic acid

Systemtic Name: 4-[7-(3-methyl-1,2-oxazol-5-yl)heptoxy]benzoic acid Openeye Name: 4-[7-(3-methylisoxazol-5-yl)heptoxy]benzoic acid CAS Name: 4-[7-(3-methyl-5-isoxazolyl)heptoxy]benzoic acid IUPAC Name: 4-[7-(3-methyl-1,2-oxazol-5-yl)heptoxy]benzoic acid Traditional Name: 4-[7-(3-methylisoxazol-5-yl)heptoxy]benzoic acid Formula: C18H23NO4 MolecularWeight: 317.37952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CCCCCCCOC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=NOC(=C1)CCCCCCCOC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C18H23NO4/c1-14-13-17(23-19-14)7-5-3-2-4-6-12-22-16-10-8-15(9-11-16)18(20)21/h8-11,13H,2-7,12H2,1H3,(H,20,21)