trisodium N,N-bis(2-carboxyethyl)carbamodithioate

Systemtic Name: trisodium N,N-bis(2-carboxyethyl)carbamodithioate Openeye Name: trisodium N,N-bis(2-carboxyethyl)carbamodithioate CAS Name: trisodium N,N-bis(2-carboxyethyl)carbamodithioate IUPAC Name: trisodium N,N-bis(2-carboxyethyl)carbamodithioate Traditional Name: trisodium N,N-bis(2-carboxyethyl)carbamodithioate Formula: C21H30N3Na3O12S6 MolecularWeight: 777.83511

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Descriptors Computed from Structure

Canonical SMILES:

C(CN(CCC(=O)O)C(=S)[S-])C(=O)O.C(CN(CCC(=O)O)C(=S)[S-])C(=O)O.C(CN(CCC(=O)O)C(=S)[S-])C(=O)O.[Na+].[Na+].[Na+]

Isomeric SMILES

C(CN(CCC(=O)O)C(=S)[S-])C(=O)O.C(CN(CCC(=O)O)C(=S)[S-])C(=O)O.C(CN(CCC(=O)O)C(=S)[S-])C(=O)O.[Na+].[Na+].[Na+]

InChI

InChI=1S/3C7H11NO4S2.3Na/c3*9-5(10)1-3-8(7(13)14)4-2-6(11)12;;;/h3*1-4H2,(H,9,10)(H,11,12)(H,13,14);;;/q;;;3*+1/p-3