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

Systemtic Name: ethyl 2-[[2-cyano-3-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]phenyl]amino]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[3-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-2-cyano-anilino]-2-oxo-acetate CAS Name: 2-[3-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-2-cyanoanilino]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[3-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)-2-hydroxypropoxy]-2-cyanoanilino]-2-oxoacetate Traditional Name: 2-[3-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-2-hydroxy-propoxy]-2-cyano-anilino]-2-keto-acetic acid ethyl ester Formula: C25H28N2O8 MolecularWeight: 484.49842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=CC=CC(=C2C#N)NC(=O)C(=O)OCC)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC(COC2=CC=CC(=C2C#N)NC(=O)C(=O)OCC)O

InChI

InChI=1S/C25H28N2O8/c1-4-7-18-22(11-10-17(15(3)28)23(18)30)35-14-16(29)13-34-21-9-6-8-20(19(21)12-26)27-24(31)25(32)33-5-2/h6,8-11,16,29-30H,4-5,7,13-14H2,1-3H3,(H,27,31)