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

Systemtic Name: 4-[2-[2-[2-(3-methoxyphenoxy)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-[2-[2-(3-methoxyphenoxy)ethoxy]phenyl]ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-[2-[2-(3-methoxyphenoxy)ethoxy]phenyl]ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-[2-[2-(3-methoxyphenoxy)ethoxy]phenyl]ethylamino]-4-oxobutanoic acid Traditional Name: 4-keto-4-[2-[2-[2-(3-methoxyphenoxy)ethoxy]phenyl]ethylamino]butyric acid Formula: C21H25NO6 MolecularWeight: 387.4263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCCOC2=CC=CC=C2CCNC(=O)CCC(=O)O

Isomeric SMILES

COC1=CC(=CC=C1)OCCOC2=CC=CC=C2CCNC(=O)CCC(=O)O

InChI

InChI=1S/C21H25NO6/c1-26-17-6-4-7-18(15-17)27-13-14-28-19-8-3-2-5-16(19)11-12-22-20(23)9-10-21(24)25/h2-8,15H,9-14H2,1H3,(H,22,23)(H,24,25)