1-[2-azanylethyl-[2-(methylamino)-2-sulfo-ethyl]amino]propane-1-sulfonic acid

Systemtic Name: 1-[2-azanylethyl-[2-(methylamino)-2-sulfo-ethyl]amino]propane-1-sulfonic acid Openeye Name: 1-[2-aminoethyl-[2-(methylamino)-2-sulfo-ethyl]amino]propane-1-sulfonic acid CAS Name: 1-[2-aminoethyl-[2-(methylamino)-2-sulfoethyl]amino]-1-propanesulfonic acid IUPAC Name: 1-[2-aminoethyl-[2-(methylamino)-2-sulfoethyl]amino]propane-1-sulfonic acid Traditional Name: 1-[2-aminoethyl-[2-(methylamino)-2-sulfo-ethyl]amino]propane-1-sulfonic acid Formula: C8H21N3O6S2 MolecularWeight: 319.39884

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N(CCN)CC(NC)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CCC(N(CCN)CC(NC)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H21N3O6S2/c1-3-8(19(15,16)17)11(5-4-9)6-7(10-2)18(12,13)14/h7-8,10H,3-6,9H2,1-2H3,(H,12,13,14)(H,15,16,17)