2-methoxy-3-[4-[2-oxidanylidene-2-(4-phenylbutan-2-ylamino)ethoxy]phenyl]propanoic acid

Systemtic Name: 2-methoxy-3-[4-[2-oxidanylidene-2-(4-phenylbutan-2-ylamino)ethoxy]phenyl]propanoic acid Openeye Name: 2-methoxy-3-[4-[2-[(1-methyl-3-phenyl-propyl)amino]-2-oxo-ethoxy]phenyl]propanoic acid CAS Name: 2-methoxy-3-[4-[2-oxo-2-(4-phenylbutan-2-ylamino)ethoxy]phenyl]propanoic acid IUPAC Name: 2-methoxy-3-[4-[2-oxo-2-(4-phenylbutan-2-ylamino)ethoxy]phenyl]propanoic acid Traditional Name: 3-[4-[2-keto-2-[(1-methyl-3-phenyl-propyl)amino]ethoxy]phenyl]-2-methoxy-propionic acid Formula: C22H27NO5 MolecularWeight: 385.45348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)COC2=CC=C(C=C2)CC(C(=O)O)OC

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)COC2=CC=C(C=C2)CC(C(=O)O)OC

InChI

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