sodium zinc 1-[6,8-bis(sulfanyl)octanoyl]-3-oxidanyl-pyrrolidine-2-carboxylate

Systemtic Name: sodium zinc 1-[6,8-bis(sulfanyl)octanoyl]-3-oxidanyl-pyrrolidine-2-carboxylate Openeye Name: sodium zinc 1-[6,8-bis(sulfanyl)octanoyl]-3-hydroxy-pyrrolidine-2-carboxylate CAS Name: sodium zinc 1-(6,8-dimercapto-1-oxooctyl)-3-hydroxy-2-pyrrolidinecarboxylate IUPAC Name: sodium zinc 1-[6,8-bis(sulfanyl)octanoyl]-3-hydroxypyrrolidine-2-carboxylate Traditional Name: sodium zinc 1-(6,8-dimercaptooctanoyl)-3-hydroxy-pyrrolidine-2-carboxylate Formula: C26H44N2NaO8S4Zn+ MolecularWeight: 729.29493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1O)C(=O)[O-])C(=O)CCCCC(CCS)S.C1CN(C(C1O)C(=O)[O-])C(=O)CCCCC(CCS)S.[Na+].[Zn+2]

Isomeric SMILES

C1CN(C(C1O)C(=O)[O-])C(=O)CCCCC(CCS)S.C1CN(C(C1O)C(=O)[O-])C(=O)CCCCC(CCS)S.[Na+].[Zn+2]

InChI

InChI=1S/2C13H23NO4S2.Na.Zn/c2*15-10-5-7-14(12(10)13(17)18)11(16)4-2-1-3-9(20)6-8-19;;/h2*9-10,12,15,19-20H,1-8H2,(H,17,18);;/q;;+1;+2/p-2