1-[2-[[(E)-4-phenyl-3-phenylmethoxycarbonyl-but-3-enoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[(E)-4-phenyl-3-phenylmethoxycarbonyl-but-3-enoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[(E)-3-benzyloxycarbonyl-4-phenyl-but-3-enoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1-oxo-2-[[(E)-1-oxo-4-phenyl-3-phenylmethoxycarbonylbut-3-enyl]amino]propyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[[(E)-4-phenyl-3-phenylmethoxycarbonylbut-3-enoyl]amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[(E)-3-carbobenzoxy-4-phenyl-but-3-enoyl]amino]propanoyl]proline Formula: C26H28N2O6 MolecularWeight: 464.51032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(=O)CC(=CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(=O)C/C(=C\C2=CC=CC=C2)/C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C26H28N2O6/c1-18(24(30)28-14-8-13-22(28)25(31)32)27-23(29)16-21(15-19-9-4-2-5-10-19)26(33)34-17-20-11-6-3-7-12-20/h2-7,9-12,15,18,22H,8,13-14,16-17H2,1H3,(H,27,29)(H,31,32)/b21-15+