1-[4-oxidanylidene-6-phenyl-5-(pyridin-4-ylcarbonylamino)hexanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-oxidanylidene-6-phenyl-5-(pyridin-4-ylcarbonylamino)hexanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-oxo-6-phenyl-5-(pyridine-4-carbonylamino)hexanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[1,4-dioxo-5-[[oxo(pyridin-4-yl)methyl]amino]-6-phenylhexyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-oxo-6-phenyl-5-(pyridine-4-carbonylamino)hexanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-(5-isonicotinamido-4-keto-6-phenyl-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=CC=CC=C2)NC(=O)C3=CC=NC=C3)C(=O)O

Isomeric SMILES

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

InChI

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