4-oxidanylidene-4-[[3-[2-(4-propylphenoxy)ethoxy]phenyl]methylamino]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[[3-[2-(4-propylphenoxy)ethoxy]phenyl]methylamino]butanoic acid Openeye Name: 4-oxo-4-[[3-[2-(4-propylphenoxy)ethoxy]phenyl]methylamino]butanoic acid CAS Name: 4-oxo-4-[[3-[2-(4-propylphenoxy)ethoxy]phenyl]methylamino]butanoic acid IUPAC Name: 4-oxo-4-[[3-[2-(4-propylphenoxy)ethoxy]phenyl]methylamino]butanoic acid Traditional Name: 4-keto-4-[[3-[2-(4-propylphenoxy)ethoxy]benzyl]amino]butyric acid Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCCOC2=CC=CC(=C2)CNC(=O)CCC(=O)O

Isomeric SMILES

CCCC1=CC=C(C=C1)OCCOC2=CC=CC(=C2)CNC(=O)CCC(=O)O

InChI

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