trisodium 2-[[ethyl(hexylsulfonyl)amino]methyl-(3-oxidanidyl-3-oxidanylidene-propyl)amino]butanedioate

Systemtic Name: trisodium 2-[[ethyl(hexylsulfonyl)amino]methyl-(3-oxidanidyl-3-oxidanylidene-propyl)amino]butanedioate Openeye Name: trisodium 2-[[ethyl(hexylsulfonyl)amino]methyl-(3-oxido-3-oxo-propyl)amino]butanedioate CAS Name: trisodium 2-[[ethyl(hexylsulfonyl)amino]methyl-(3-oxido-3-oxopropyl)amino]butanedioate IUPAC Name: trisodium 2-[[ethyl(hexylsulfonyl)amino]methyl-(3-oxido-3-oxopropyl)amino]butanedioate Traditional Name: trisodium 2-[[ethyl(hexylsulfonyl)amino]methyl-(3-keto-3-oxido-propyl)amino]succinate Formula: C16H27N2Na3O8S MolecularWeight: 476.42849

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCS(=O)(=O)N(CC)CN(CCC(=O)[O-])C(CC(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CCCCCCS(=O)(=O)N(CC)CN(CCC(=O)[O-])C(CC(=O)[O-])C(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C16H30N2O8S.3Na/c1-3-5-6-7-10-27(25,26)18(4-2)12-17(9-8-14(19)20)13(16(23)24)11-15(21)22;;;/h13H,3-12H2,1-2H3,(H,19,20)(H,21,22)(H,23,24);;;/q;3*+1/p-3