3-[2-[(2-methoxy-2-phenyl-ethyl)carbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-[(2-methoxy-2-phenyl-ethyl)carbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid Openeye Name: 3-[2-[(2-methoxy-2-phenyl-ethyl)carbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid CAS Name: 3-[2-[[(2-methoxy-2-phenylethyl)amino]-oxomethyl]-4-(phenoxymethyl)phenyl]propanoic acid IUPAC Name: 3-[2-[(2-methoxy-2-phenylethyl)carbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid Traditional Name: 3-[2-[(2-methoxy-2-phenyl-ethyl)carbamoyl]-4-(phenoxymethyl)phenyl]propionic acid Formula: C26H27NO5 MolecularWeight: 433.49628

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=O)C1=C(C=CC(=C1)COC2=CC=CC=C2)CCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

COC(CNC(=O)C1=C(C=CC(=C1)COC2=CC=CC=C2)CCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C26H27NO5/c1-31-24(21-8-4-2-5-9-21)17-27-26(30)23-16-19(12-13-20(23)14-15-25(28)29)18-32-22-10-6-3-7-11-22/h2-13,16,24H,14-15,17-18H2,1H3,(H,27,30)(H,28,29)