4-[2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxo-butanoate CAS Name: 4-[2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-[2-[2-(2,6-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxobutanoate Traditional Name: 4-[2-[2-[2-(2,6-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)C)OCCOC2=CC=CC=C2CCNC(=O)CCC(=O)[O-]

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCOC2=CC=CC=C2CCNC(=O)CCC(=O)[O-]

InChI

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