(2S)-1-[5-benzamido-4-oxidanylidene-6-(4-phenylmethoxyphenyl)hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[5-benzamido-4-oxidanylidene-6-(4-phenylmethoxyphenyl)hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[5-benzamido-6-(4-benzyloxyphenyl)-4-oxo-hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[5-benzamido-1,4-dioxo-6-(4-phenylmethoxyphenyl)hexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[5-benzamido-4-oxo-6-(4-phenylmethoxyphenyl)hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[5-benzamido-6-(4-benzoxyphenyl)-4-keto-hexanoyl]proline Formula: C31H32N2O6 MolecularWeight: 528.59558

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C[C@H](N(C1)C(=O)CCC(=O)C(CC2=CC=C(C=C2)OCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C31H32N2O6/c34-28(17-18-29(35)33-19-7-12-27(33)31(37)38)26(32-30(36)24-10-5-2-6-11-24)20-22-13-15-25(16-14-22)39-21-23-8-3-1-4-9-23/h1-6,8-11,13-16,26-27H,7,12,17-21H2,(H,32,36)(H,37,38)/t26?,27-/m0/s1