2-[3-(2H-chromen-3-yl)-5-[(4-methoxyphenyl)carbamoyl]-4H-1,2-oxazol-5-yl]ethanoic acid

Systemtic Name: 2-[3-(2H-chromen-3-yl)-5-[(4-methoxyphenyl)carbamoyl]-4H-1,2-oxazol-5-yl]ethanoic acid Openeye Name: 2-[3-(2H-chromen-3-yl)-5-[(4-methoxyphenyl)carbamoyl]-4H-isoxazol-5-yl]acetic acid CAS Name: 2-[3-(2H-1-benzopyran-3-yl)-5-[(4-methoxyanilino)-oxomethyl]-4H-isoxazol-5-yl]acetic acid IUPAC Name: 2-[3-(2H-chromen-3-yl)-5-[(4-methoxyphenyl)carbamoyl]-4H-1,2-oxazol-5-yl]acetic acid Traditional Name: 2-[3-(2H-chromen-3-yl)-5-[(4-methoxyphenyl)carbamoyl]-2-isoxazolin-5-yl]acetic acid Formula: C22H20N2O6 MolecularWeight: 408.404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2(CC(=NO2)C3=CC4=CC=CC=C4OC3)CC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2(CC(=NO2)C3=CC4=CC=CC=C4OC3)CC(=O)O

InChI

InChI=1S/C22H20N2O6/c1-28-17-8-6-16(7-9-17)23-21(27)22(12-20(25)26)11-18(24-30-22)15-10-14-4-2-3-5-19(14)29-13-15/h2-10H,11-13H2,1H3,(H,23,27)(H,25,26)