3-[4-[2-(dimethylamino)-6-methoxy-phenyl]phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid

Systemtic Name: 3-[4-[2-(dimethylamino)-6-methoxy-phenyl]phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-3-[4-[2-(dimethylamino)-6-methoxy-phenyl]phenyl]propanoic acid CAS Name: 3-[4-[2-(dimethylamino)-6-methoxyphenyl]phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid IUPAC Name: 3-[4-[2-(dimethylamino)-6-methoxyphenyl]phenyl]-2-(phenylmethoxycarbonylamino)propanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-3-[4-[2-(dimethylamino)-6-methoxy-phenyl]phenyl]propionic acid Formula: C26H28N2O5 MolecularWeight: 448.51092

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C(=CC=C1)OC)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CN(C)C1=C(C(=CC=C1)OC)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H28N2O5/c1-28(2)22-10-7-11-23(32-3)24(22)20-14-12-18(13-15-20)16-21(25(29)30)27-26(31)33-17-19-8-5-4-6-9-19/h4-15,21H,16-17H2,1-3H3,(H,27,31)(H,29,30)