4-oxidanylidene-4-[[2-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylamino]butanoate

Systemtic Name: 4-oxidanylidene-4-[[2-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylamino]butanoate Openeye Name: 4-oxo-4-[[2-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylamino]butanoate CAS Name: 4-oxo-4-[[2-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylamino]butanoate IUPAC Name: 4-oxo-4-[[2-[2-(2,3,6-trimethylphenoxy)ethoxy]phenyl]methylamino]butanoate Traditional Name: 4-keto-4-[[2-[2-(2,3,6-trimethylphenoxy)ethoxy]benzyl]amino]butyrate Formula: C22H26NO5- MolecularWeight: 384.44554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCCOC2=CC=CC=C2CNC(=O)CCC(=O)[O-])C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCCOC2=CC=CC=C2CNC(=O)CCC(=O)[O-])C

InChI

InChI=1S/C22H27NO5/c1-15-8-9-16(2)22(17(15)3)28-13-12-27-19-7-5-4-6-18(19)14-23-20(24)10-11-21(25)26/h4-9H,10-14H2,1-3H3,(H,23,24)(H,25,26)/p-1