2-[[2-cyano-3-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[[2-cyano-3-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]phenyl]amino]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[3-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-cyano-anilino]-2-oxo-acetic acid CAS Name: 2-[3-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-cyanoanilino]-2-oxoacetic acid IUPAC Name: 2-[3-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-2-cyanoanilino]-2-oxoacetic acid Traditional Name: 2-[3-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-2-cyano-anilino]-2-keto-acetic acid Formula: C23H24N2O7 MolecularWeight: 440.44586

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC=CC(=C2C#N)NC(=O)C(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCOC2=CC=CC(=C2C#N)NC(=O)C(=O)O

InChI

InChI=1S/C23H24N2O7/c1-3-6-16-20(10-9-15(14(2)26)21(16)27)32-12-5-11-31-19-8-4-7-18(17(19)13-24)25-22(28)23(29)30/h4,7-10,27H,3,5-6,11-12H2,1-2H3,(H,25,28)(H,29,30)