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

Systemtic Name: 5-[4-[2-(3,5-dimethoxyphenyl)ethanoylamino]phenyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[4-[[2-(3,5-dimethoxyphenyl)acetyl]amino]phenyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[4-[[2-(3,5-dimethoxyphenyl)-1-oxoethyl]amino]phenyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[4-[[2-(3,5-dimethoxyphenyl)acetyl]amino]phenyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[4-[[2-(3,5-dimethoxyphenyl)acetyl]amino]phenyl]-2-methyl-3-furoic acid Formula: C22H21NO6 MolecularWeight: 395.40524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21NO6/c1-13-19(22(25)26)12-20(29-13)15-4-6-16(7-5-15)23-21(24)10-14-8-17(27-2)11-18(9-14)28-3/h4-9,11-12H,10H2,1-3H3,(H,23,24)(H,25,26)