2-[[3,5-dimethyl-4-[4-oxidanyl-3-(pyridin-3-ylcarbamoyl)phenoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[3,5-dimethyl-4-[4-oxidanyl-3-(pyridin-3-ylcarbamoyl)phenoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-[4-hydroxy-3-(3-pyridylcarbamoyl)phenoxy]-3,5-dimethyl-anilino]-2-oxo-acetic acid CAS Name: 2-[4-[4-hydroxy-3-[oxo-(3-pyridinylamino)methyl]phenoxy]-3,5-dimethylanilino]-2-oxoacetic acid IUPAC Name: 2-[4-[4-hydroxy-3-(pyridin-3-ylcarbamoyl)phenoxy]-3,5-dimethylanilino]-2-oxoacetic acid Traditional Name: 2-[4-[4-hydroxy-3-(3-pyridylcarbamoyl)phenoxy]-3,5-dimethyl-anilino]-2-keto-acetic acid Formula: C22H19N3O6 MolecularWeight: 421.40276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(=O)NC3=CN=CC=C3)C)NC(=O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(=O)NC3=CN=CC=C3)C)NC(=O)C(=O)O

InChI

InChI=1S/C22H19N3O6/c1-12-8-15(25-21(28)22(29)30)9-13(2)19(12)31-16-5-6-18(26)17(10-16)20(27)24-14-4-3-7-23-11-14/h3-11,26H,1-2H3,(H,24,27)(H,25,28)(H,29,30)