4-[2-[2-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[2-[2-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxidanylidene-butanoate Openeye Name: 4-[2-[2-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxo-butanoate CAS Name: 4-[2-[2-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxobutanoate IUPAC Name: 4-[2-[2-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-oxobutanoate Traditional Name: 4-[2-[2-[2-(2,5-dimethylphenoxy)ethoxy]phenyl]ethylamino]-4-keto-butyrate Formula: C22H26NO5- MolecularWeight: 384.44554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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