3-(4-hydroxyphenyl)-2-[[4-(phenylmethoxycarbonylaminomethyl)phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-(4-hydroxyphenyl)-2-[[4-(phenylmethoxycarbonylaminomethyl)phenyl]carbonylamino]propanoic acid Openeye Name: 2-[[4-(benzyloxycarbonylaminomethyl)benzoyl]amino]-3-(4-hydroxyphenyl)propanoic acid CAS Name: 3-(4-hydroxyphenyl)-2-[[oxo-[4-(phenylmethoxycarbonylaminomethyl)phenyl]methyl]amino]propanoic acid IUPAC Name: 3-(4-hydroxyphenyl)-2-[[4-(phenylmethoxycarbonylaminomethyl)benzoyl]amino]propanoic acid Traditional Name: 2-[[4-(benzyloxycarbonylaminomethyl)benzoyl]amino]-3-(4-hydroxyphenyl)propionic acid Formula: C25H24N2O6 MolecularWeight: 448.46786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCC2=CC=C(C=C2)C(=O)NC(CC3=CC=C(C=C3)O)C(=O)O

InChI

InChI=1S/C25H24N2O6/c28-21-12-8-17(9-13-21)14-22(24(30)31)27-23(29)20-10-6-18(7-11-20)15-26-25(32)33-16-19-4-2-1-3-5-19/h1-13,22,28H,14-16H2,(H,26,32)(H,27,29)(H,30,31)