(2S)-4-oxidanylidene-4-phenylmethoxy-2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoic acid

Systemtic Name: (2S)-4-oxidanylidene-4-phenylmethoxy-2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoic acid Openeye Name: (2S)-4-benzyloxy-2-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-4-oxo-butanoic acid CAS Name: (2S)-4-oxo-2-[[(2S)-1-oxo-3-phenyl-2-(phenylmethoxycarbonylamino)propyl]amino]-4-phenylmethoxybutanoic acid IUPAC Name: (2S)-4-oxo-4-phenylmethoxy-2-[[(2S)-3-phenyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoic acid Traditional Name: (2S)-4-benzoxy-2-[[(2S)-2-(benzyloxycarbonylamino)-3-phenyl-propanoyl]amino]-4-keto-butyric acid Formula: C28H28N2O7 MolecularWeight: 504.53112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CC(=O)OCC2=CC=CC=C2)C(=O)O)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CC(=O)OCC2=CC=CC=C2)C(=O)O)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C28H28N2O7/c31-25(36-18-21-12-6-2-7-13-21)17-24(27(33)34)29-26(32)23(16-20-10-4-1-5-11-20)30-28(35)37-19-22-14-8-3-9-15-22/h1-15,23-24H,16-19H2,(H,29,32)(H,30,35)(H,33,34)/t23-,24-/m0/s1