3-phenylmethoxy-2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoic acid

Systemtic Name: 3-phenylmethoxy-2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoic acid Openeye Name: 3-benzyloxy-2-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]propanoic acid CAS Name: 2-[[1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]-3-phenylmethoxypropanoic acid IUPAC Name: 3-phenylmethoxy-2-[[3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoic acid Traditional Name: 3-benzoxy-2-[[2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]propionic acid Formula: C27H28N2O6 MolecularWeight: 476.52102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(COCC2=CC=CC=C2)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NC(COCC2=CC=CC=C2)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C27H28N2O6/c30-25(28-24(26(31)32)19-34-17-21-12-6-2-7-13-21)23(16-20-10-4-1-5-11-20)29-27(33)35-18-22-14-8-3-9-15-22/h1-15,23-24H,16-19H2,(H,28,30)(H,29,33)(H,31,32)