3-[[2-[(1-oxidanylidene-3-phenyl-1-phenylmethoxy-propan-2-yl)amino]-3-phenyl-propanoyl]amino]propanoic acid

Systemtic Name: 3-[[2-[(1-oxidanylidene-3-phenyl-1-phenylmethoxy-propan-2-yl)amino]-3-phenyl-propanoyl]amino]propanoic acid Openeye Name: 3-[[2-[(1-benzyl-2-benzyloxy-2-oxo-ethyl)amino]-3-phenyl-propanoyl]amino]propanoic acid CAS Name: 3-[[1-oxo-2-[(1-oxo-3-phenyl-1-phenylmethoxypropan-2-yl)amino]-3-phenylpropyl]amino]propanoic acid IUPAC Name: 3-[[2-[(1-oxo-3-phenyl-1-phenylmethoxypropan-2-yl)amino]-3-phenylpropanoyl]amino]propanoic acid Traditional Name: 3-[[2-[(2-benzoxy-1-benzyl-2-keto-ethyl)amino]-3-phenyl-propanoyl]amino]propionic acid Formula: C28H30N2O5 MolecularWeight: 474.5482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCC(=O)O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCCC(=O)O)NC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H30N2O5/c31-26(32)16-17-29-27(33)24(18-21-10-4-1-5-11-21)30-25(19-22-12-6-2-7-13-22)28(34)35-20-23-14-8-3-9-15-23/h1-15,24-25,30H,16-20H2,(H,29,33)(H,31,32)