(2S)-2-(phenylmethoxycarbonylamino)-3-[4-(3-phenylpropoxy)phenyl]propanoic acid

Systemtic Name: (2S)-2-(phenylmethoxycarbonylamino)-3-[4-(3-phenylpropoxy)phenyl]propanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-3-[4-(3-phenylpropoxy)phenyl]propanoic acid CAS Name: (2S)-2-(phenylmethoxycarbonylamino)-3-[4-(3-phenylpropoxy)phenyl]propanoic acid IUPAC Name: (2S)-2-(phenylmethoxycarbonylamino)-3-[4-(3-phenylpropoxy)phenyl]propanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-[4-(3-phenylpropoxy)phenyl]propionic acid Formula: C26H27NO5 MolecularWeight: 433.49628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)CC(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CCCOC2=CC=C(C=C2)C[C@@H](C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H27NO5/c28-25(29)24(27-26(30)32-19-22-10-5-2-6-11-22)18-21-13-15-23(16-14-21)31-17-7-12-20-8-3-1-4-9-20/h1-6,8-11,13-16,24H,7,12,17-19H2,(H,27,30)(H,28,29)/t24-/m0/s1