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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=CC=C(C=C1)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

COC(CC1=CC=C(C=C1)OCC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H29NO5/c1-32-25(27(30)31)18-22-12-14-24(15-13-22)33-20-26(29)28(19-23-10-6-3-7-11-23)17-16-21-8-4-2-5-9-21/h2-15,25H,16-20H2,1H3,(H,30,31)