4-[[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]methyl]-5-methyl-furan-2-carboxylic acid

Systemtic Name: 4-[[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]methyl]-5-methyl-furan-2-carboxylic acid Openeye Name: 4-[[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]methyl]-5-methyl-furan-2-carboxylic acid CAS Name: 4-[[4-[(2,3-dimethylanilino)-oxomethyl]phenoxy]methyl]-5-methyl-2-furancarboxylic acid IUPAC Name: 4-[[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]methyl]-5-methylfuran-2-carboxylic acid Traditional Name: 4-[[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]methyl]-5-methyl-2-furoic acid Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)OCC3=C(OC(=C3)C(=O)O)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)OCC3=C(OC(=C3)C(=O)O)C)C

InChI

InChI=1S/C22H21NO5/c1-13-5-4-6-19(14(13)2)23-21(24)16-7-9-18(10-8-16)27-12-17-11-20(22(25)26)28-15(17)3/h4-11H,12H2,1-3H3,(H,23,24)(H,25,26)