3-pentyl-5-[phenylmethoxy-[4-(trifluoromethyl)phenyl]methyl]-4H-1,2-oxazole-5-carboxylic acid

Systemtic Name: 3-pentyl-5-[phenylmethoxy-[4-(trifluoromethyl)phenyl]methyl]-4H-1,2-oxazole-5-carboxylic acid Openeye Name: 5-[benzyloxy-[4-(trifluoromethyl)phenyl]methyl]-3-pentyl-4H-isoxazole-5-carboxylic acid CAS Name: 3-pentyl-5-[phenylmethoxy-[4-(trifluoromethyl)phenyl]methyl]-4H-isoxazole-5-carboxylic acid IUPAC Name: 3-pentyl-5-[phenylmethoxy-[4-(trifluoromethyl)phenyl]methyl]-4H-1,2-oxazole-5-carboxylic acid Traditional Name: 3-amyl-5-[benzoxy-[4-(trifluoromethyl)phenyl]methyl]-2-isoxazoline-5-carboxylic acid Formula: C24H26F3NO4 MolecularWeight: 449.46275

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NOC(C1)(C(C2=CC=C(C=C2)C(F)(F)F)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCCC1=NOC(C1)(C(C2=CC=C(C=C2)C(F)(F)F)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H26F3NO4/c1-2-3-5-10-20-15-23(22(29)30,32-28-20)21(31-16-17-8-6-4-7-9-17)18-11-13-19(14-12-18)24(25,26)27/h4,6-9,11-14,21H,2-3,5,10,15-16H2,1H3,(H,29,30)