5-[4-[2-[3,5-bis(oxidanyl)phenyl]ethanoylamino]phenyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[4-[2-[3,5-bis(oxidanyl)phenyl]ethanoylamino]phenyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[4-[[2-(3,5-dihydroxyphenyl)acetyl]amino]phenyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[4-[[2-(3,5-dihydroxyphenyl)-1-oxoethyl]amino]phenyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[4-[[2-(3,5-dihydroxyphenyl)acetyl]amino]phenyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[4-[[2-(3,5-dihydroxyphenyl)acetyl]amino]phenyl]-2-methyl-3-furoic acid Formula: C20H17NO6 MolecularWeight: 367.35208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C2=CC=C(C=C2)NC(=O)CC3=CC(=CC(=C3)O)O)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)C2=CC=C(C=C2)NC(=O)CC3=CC(=CC(=C3)O)O)C(=O)O

InChI

InChI=1S/C20H17NO6/c1-11-17(20(25)26)10-18(27-11)13-2-4-14(5-3-13)21-19(24)8-12-6-15(22)9-16(23)7-12/h2-7,9-10,22-23H,8H2,1H3,(H,21,24)(H,25,26)