4-[2-[4-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-[4-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-[4-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxo-butanoate CAS Name: 4-[2-[4-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-[4-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxobutanoate Traditional Name: 4-[2-[4-[2-(2,3-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-keto-butyrate Formula: C22H26NO5- MolecularWeight: 384.44554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCCOC2=CC=C(C=C2)CCNC(=O)CCC(=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)OCCOC2=CC=C(C=C2)CCNC(=O)CCC(=O)[O-])C

InChI

InChI=1S/C22H27NO5/c1-16-4-3-5-20(17(16)2)28-15-14-27-19-8-6-18(7-9-19)12-13-23-21(24)10-11-22(25)26/h3-9H,10-15H2,1-2H3,(H,23,24)(H,25,26)/p-1