2-methoxy-3-[4-[2-oxidanylidene-2-[1-phenylethyl-(phenylmethyl)amino]ethoxy]phenyl]propanoic acid

Systemtic Name: 2-methoxy-3-[4-[2-oxidanylidene-2-[1-phenylethyl-(phenylmethyl)amino]ethoxy]phenyl]propanoic acid Openeye Name: 3-[4-[2-[benzyl(1-phenylethyl)amino]-2-oxo-ethoxy]phenyl]-2-methoxy-propanoic acid CAS Name: 2-methoxy-3-[4-[2-oxo-2-[1-phenylethyl-(phenylmethyl)amino]ethoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[2-[benzyl(1-phenylethyl)amino]-2-oxoethoxy]phenyl]-2-methoxypropanoic acid Traditional Name: 3-[4-[2-[benzyl(1-phenylethyl)amino]-2-keto-ethoxy]phenyl]-2-methoxy-propionic acid Formula: C27H29NO5 MolecularWeight: 447.52286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)CC(C(=O)O)OC

Isomeric SMILES

CC(C1=CC=CC=C1)N(CC2=CC=CC=C2)C(=O)COC3=CC=C(C=C3)CC(C(=O)O)OC

InChI

InChI=1S/C27H29NO5/c1-20(23-11-7-4-8-12-23)28(18-22-9-5-3-6-10-22)26(29)19-33-24-15-13-21(14-16-24)17-25(32-2)27(30)31/h3-16,20,25H,17-19H2,1-2H3,(H,30,31)