4-[3-[bis(2-hydroxyethyl)amino]propanoylamino]-4-methyl-1,1-bis(oxidanylidene)thiolane-3-sulfonate

Systemtic Name: 4-[3-[bis(2-hydroxyethyl)amino]propanoylamino]-4-methyl-1,1-bis(oxidanylidene)thiolane-3-sulfonate Openeye Name: 4-[3-[bis(2-hydroxyethyl)amino]propanoylamino]-4-methyl-1,1-dioxo-thiolane-3-sulfonate CAS Name: 4-[[3-[bis(2-hydroxyethyl)amino]-1-oxopropyl]amino]-4-methyl-1,1-dioxo-3-thiolanesulfonate IUPAC Name: 4-[3-[bis(2-hydroxyethyl)amino]propanoylamino]-4-methyl-1,1-dioxothiolane-3-sulfonate Traditional Name: 4-[3-[bis(2-hydroxyethyl)amino]propanoylamino]-1,1-diketo-4-methyl-thiolane-3-sulfonate Formula: C12H23N2O8S2- MolecularWeight: 387.44962

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CS(=O)(=O)CC1S(=O)(=O)[O-])NC(=O)CCN(CCO)CCO

Isomeric SMILES

CC1(CS(=O)(=O)CC1S(=O)(=O)[O-])NC(=O)CCN(CCO)CCO

InChI

InChI=1S/C12H24N2O8S2/c1-12(9-23(18,19)8-10(12)24(20,21)22)13-11(17)2-3-14(4-6-15)5-7-16/h10,15-16H,2-9H2,1H3,(H,13,17)(H,20,21,22)/p-1