(2S)-1-(5-benzamido-4-oxidanylidene-6-pyridin-3-yl-hexanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-(5-benzamido-4-oxidanylidene-6-pyridin-3-yl-hexanoyl)pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[5-benzamido-4-oxo-6-(3-pyridyl)hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[5-benzamido-1,4-dioxo-6-(3-pyridinyl)hexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-(5-benzamido-4-oxo-6-pyridin-3-ylhexanoyl)pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[5-benzamido-4-keto-6-(3-pyridyl)hexanoyl]proline Formula: C23H25N3O5 MolecularWeight: 423.4617

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25N3O5/c27-20(10-11-21(28)26-13-5-9-19(26)23(30)31)18(14-16-6-4-12-24-15-16)25-22(29)17-7-2-1-3-8-17/h1-4,6-8,12,15,18-19H,5,9-11,13-14H2,(H,25,29)(H,30,31)/t18?,19-/m0/s1