4-[[3-[2-(4-fluoranylphenoxy)ethoxy]-4-methoxy-phenyl]methylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[3-[2-(4-fluoranylphenoxy)ethoxy]-4-methoxy-phenyl]methylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[3-[2-(4-fluorophenoxy)ethoxy]-4-methoxy-phenyl]methylamino]-4-oxo-butanoic acid CAS Name: 4-[[3-[2-(4-fluorophenoxy)ethoxy]-4-methoxyphenyl]methylamino]-4-oxobutanoic acid IUPAC Name: 4-[[3-[2-(4-fluorophenoxy)ethoxy]-4-methoxyphenyl]methylamino]-4-oxobutanoic acid Traditional Name: 4-[[3-[2-(4-fluorophenoxy)ethoxy]-4-methoxy-benzyl]amino]-4-keto-butyric acid Formula: C20H22FNO6 MolecularWeight: 391.390183

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCC(=O)O)OCCOC2=CC=C(C=C2)F

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCC(=O)O)OCCOC2=CC=C(C=C2)F

InChI

InChI=1S/C20H22FNO6/c1-26-17-7-2-14(13-22-19(23)8-9-20(24)25)12-18(17)28-11-10-27-16-5-3-15(21)4-6-16/h2-7,12H,8-11,13H2,1H3,(H,22,23)(H,24,25)