2-[4-(carboxymethyl)-7-methylsulfonyl-1,4,7-triazonan-1-yl]ethanoic acid

Systemtic Name: 2-[4-(carboxymethyl)-7-methylsulfonyl-1,4,7-triazonan-1-yl]ethanoic acid Openeye Name: 2-[4-(carboxymethyl)-7-methylsulfonyl-1,4,7-triazonan-1-yl]acetic acid CAS Name: 2-[4-(carboxymethyl)-7-methylsulfonyl-1,4,7-triazonan-1-yl]acetic acid IUPAC Name: 2-[4-(carboxymethyl)-7-methylsulfonyl-1,4,7-triazonan-1-yl]acetic acid Traditional Name: 2-[4-(carboxymethyl)-7-mesyl-1,4,7-triazonan-1-yl]acetic acid Formula: C11H21N3O6S MolecularWeight: 323.36594

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CCN(CC1)CC(=O)O)CC(=O)O

Isomeric SMILES

CS(=O)(=O)N1CCN(CCN(CC1)CC(=O)O)CC(=O)O

InChI

InChI=1S/C11H21N3O6S/c1-21(19,20)14-6-4-12(8-10(15)16)2-3-13(5-7-14)9-11(17)18/h2-9H2,1H3,(H,15,16)(H,17,18)