(2R)-1-(azepan-1-ylsulfonyl)piperidin-1-ium-2-carboxylate

Systemtic Name: (2R)-1-(azepan-1-ylsulfonyl)piperidin-1-ium-2-carboxylate Openeye Name: (2R)-1-(azepan-1-ylsulfonyl)piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-(1-azepanylsulfonyl)-2-piperidin-1-iumcarboxylate IUPAC Name: (2R)-1-(azepan-1-ylsulfonyl)piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-(azepan-1-ylsulfonyl)piperidin-1-ium-2-carboxylate Formula: C12H22N2O4S MolecularWeight: 290.37908

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)[NH+]2CCCCC2C(=O)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)[NH+]2CCCC[C@@H]2C(=O)[O-]

InChI

InChI=1S/C12H22N2O4S/c15-12(16)11-7-3-6-10-14(11)19(17,18)13-8-4-1-2-5-9-13/h11H,1-10H2,(H,15,16)/t11-/m1/s1