2-[2-[4-(2-hydroxyethyl)piperazin-1-yl]ethylsulfonyloxy]-3-oxidanyl-butanedioic acid

Systemtic Name: 2-[2-[4-(2-hydroxyethyl)piperazin-1-yl]ethylsulfonyloxy]-3-oxidanyl-butanedioic acid Openeye Name: 2-hydroxy-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]ethylsulfonyloxy]butanedioic acid CAS Name: 2-hydroxy-3-[2-[4-(2-hydroxyethyl)-1-piperazinyl]ethylsulfonyloxy]butanedioic acid IUPAC Name: 2-hydroxy-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]ethylsulfonyloxy]butanedioic acid Traditional Name: 2-hydroxy-3-[2-[4-(2-hydroxyethyl)piperazino]ethylsulfonyloxy]succinic acid Formula: C12H22N2O9S MolecularWeight: 370.37608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)CCS(=O)(=O)OC(C(C(=O)O)O)C(=O)O

Isomeric SMILES

C1CN(CCN1CCO)CCS(=O)(=O)OC(C(C(=O)O)O)C(=O)O

InChI

InChI=1S/C12H22N2O9S/c15-7-5-13-1-3-14(4-2-13)6-8-24(21,22)23-10(12(19)20)9(16)11(17)18/h9-10,15-16H,1-8H2,(H,17,18)(H,19,20)