disodium 1-(4-benzamido-5-oxidanidyl-5-oxidanylidene-pentanoyl)pyrrolidine-2-carboxylate

Systemtic Name: disodium 1-(4-benzamido-5-oxidanidyl-5-oxidanylidene-pentanoyl)pyrrolidine-2-carboxylate Openeye Name: disodium 1-(4-benzamido-5-oxido-5-oxo-pentanoyl)pyrrolidine-2-carboxylate CAS Name: disodium 1-(4-benzamido-5-oxido-1,5-dioxopentyl)-2-pyrrolidinecarboxylate IUPAC Name: disodium 1-(4-benzamido-5-oxido-5-oxopentanoyl)pyrrolidine-2-carboxylate Traditional Name: disodium 1-(4-benzamido-5-keto-5-oxido-pentanoyl)pyrrolidine-2-carboxylate Formula: C17H18N2Na2O6 MolecularWeight: 392.31416

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CCC(C(=O)[O-])NC(=O)C2=CC=CC=C2)C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1CC(N(C1)C(=O)CCC(C(=O)[O-])NC(=O)C2=CC=CC=C2)C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C17H20N2O6.2Na/c20-14(19-10-4-7-13(19)17(24)25)9-8-12(16(22)23)18-15(21)11-5-2-1-3-6-11;;/h1-3,5-6,12-13H,4,7-10H2,(H,18,21)(H,22,23)(H,24,25);;/q;2*+1/p-2