2,3-bis(2-carboxyethylsulfanylmethyl)-2-(1-sulfamoylethyl)butanedioic acid; ethanesulfonamide

Systemtic Name: 2,3-bis(2-carboxyethylsulfanylmethyl)-2-(1-sulfamoylethyl)butanedioic acid; ethanesulfonamide Openeye Name: 2,3-bis(2-carboxyethylsulfanylmethyl)-2-(1-sulfamoylethyl)butanedioic acid; ethanesulfonamide CAS Name: 2,3-bis[(2-carboxyethylthio)methyl]-2-(1-sulfamoylethyl)butanedioic acid; ethanesulfonamide IUPAC Name: 2,3-bis(2-carboxyethylsulfanylmethyl)-2-(1-sulfamoylethyl)butanedioic acid; ethanesulfonamide Traditional Name: 2,3-bis[(2-carboxyethylthio)methyl]-2-(1-sulfamoylethyl)succinic acid; ethanesulfonamide Formula: C16H30N2O12S4 MolecularWeight: 570.6756

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N.CC(C(CSCCC(=O)O)(C(CSCCC(=O)O)C(=O)O)C(=O)O)S(=O)(=O)N

Isomeric SMILES

CCS(=O)(=O)N.CC(C(CSCCC(=O)O)(C(CSCCC(=O)O)C(=O)O)C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C14H23NO10S3.C2H7NO2S/c1-8(28(15,24)25)14(13(22)23,7-27-5-3-11(18)19)9(12(20)21)6-26-4-2-10(16)17;1-2-6(3,4)5/h8-9H,2-7H2,1H3,(H,16,17)(H,18,19)(H,20,21)(H,22,23)(H2,15,24,25);2H2,1H3,(H2,3,4,5)