4-[2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-[3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl]ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-[3-ethoxy-4-(2-fluorobenzyl)oxy-phenyl]ethylamino]-4-keto-butyric acid Formula: C21H24FNO5 MolecularWeight: 389.417363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CCNC(=O)CCC(=O)O)OCC2=CC=CC=C2F

Isomeric SMILES

CCOC1=C(C=CC(=C1)CCNC(=O)CCC(=O)O)OCC2=CC=CC=C2F

InChI

InChI=1S/C21H24FNO5/c1-2-27-19-13-15(11-12-23-20(24)9-10-21(25)26)7-8-18(19)28-14-16-5-3-4-6-17(16)22/h3-8,13H,2,9-12,14H2,1H3,(H,23,24)(H,25,26)