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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CCNC(=O)CCC(=O)O)OCC2=CC=C(C=C2)F

Isomeric SMILES

CCOC1=C(C=CC(=C1)CCNC(=O)CCC(=O)O)OCC2=CC=C(C=C2)F

InChI

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