2-[[(2S)-4-oxidanylidene-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[[(2S)-4-oxidanylidene-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenyl-propanoic acid Openeye Name: 2-[[(2S)-4-benzyloxy-2-(benzyloxycarbonylamino)-4-oxo-butanoyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[(2S)-1,4-dioxo-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[(2S)-4-oxo-4-phenylmethoxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[(2S)-4-benzoxy-2-(benzyloxycarbonylamino)-4-keto-butanoyl]amino]-3-phenyl-propionic acid Formula: C28H28N2O7 MolecularWeight: 504.53112

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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