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

Systemtic Name: 4-[2-[3-[(4-chlorophenyl)methoxy]-4-methoxy-phenyl]ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[3-[(4-chlorophenyl)methoxy]-4-methoxy-phenyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-[3-[(4-chlorophenyl)methoxy]-4-methoxyphenyl]ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-[3-[(4-chlorophenyl)methoxy]-4-methoxyphenyl]ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-[3-(4-chlorobenzyl)oxy-4-methoxy-phenyl]ethylamino]-4-keto-butyric acid Formula: C20H22ClNO5 MolecularWeight: 391.84538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCC(=O)O)OCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCC(=O)O)OCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C20H22ClNO5/c1-26-17-7-4-14(10-11-22-19(23)8-9-20(24)25)12-18(17)27-13-15-2-5-16(21)6-3-15/h2-7,12H,8-11,13H2,1H3,(H,22,23)(H,24,25)