2-[5-(cyclohexylcarbamoyl)-3-(3,4-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]ethanoic acid

Systemtic Name: 2-[5-(cyclohexylcarbamoyl)-3-(3,4-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[5-(cyclohexylcarbamoyl)-3-(3,4-dimethoxyphenyl)-4H-isoxazol-5-yl]acetic acid CAS Name: 2-[5-[(cyclohexylamino)-oxomethyl]-3-(3,4-dimethoxyphenyl)-4H-isoxazol-5-yl]acetic acid IUPAC Name: 2-[5-(cyclohexylcarbamoyl)-3-(3,4-dimethoxyphenyl)-4H-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-[5-(cyclohexylcarbamoyl)-3-(3,4-dimethoxyphenyl)-2-isoxazolin-5-yl]acetic acid Formula: C20H26N2O6 MolecularWeight: 390.43024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(C2)(CC(=O)O)C(=O)NC3CCCCC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(C2)(CC(=O)O)C(=O)NC3CCCCC3)OC

InChI

InChI=1S/C20H26N2O6/c1-26-16-9-8-13(10-17(16)27-2)15-11-20(28-22-15,12-18(23)24)19(25)21-14-6-4-3-5-7-14/h8-10,14H,3-7,11-12H2,1-2H3,(H,21,25)(H,23,24)