1-methyl-4-[(3R)-piperidin-1-ium-3-yl]sulfonyl-1,4-diazepan-1-ium

Systemtic Name: 1-methyl-4-[(3R)-piperidin-1-ium-3-yl]sulfonyl-1,4-diazepan-1-ium Openeye Name: 1-methyl-4-[(3R)-piperidin-1-ium-3-yl]sulfonyl-1,4-diazepan-1-ium CAS Name: 1-methyl-4-[[(3R)-3-piperidin-1-iumyl]sulfonyl]-1,4-diazepan-1-ium IUPAC Name: 1-methyl-4-[(3R)-piperidin-1-ium-3-yl]sulfonyl-1,4-diazepan-1-ium Traditional Name: 1-methyl-4-[(3R)-piperidin-1-ium-3-yl]sulfonyl-1,4-diazepan-1-ium Formula: C11H25N3O2S+2 MolecularWeight: 263.4001

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCN(CC1)S(=O)(=O)C2CCC[NH2+]C2

Isomeric SMILES

C[NH+]1CCCN(CC1)S(=O)(=O)[C@@H]2CCC[NH2+]C2

InChI

InChI=1S/C11H23N3O2S/c1-13-6-3-7-14(9-8-13)17(15,16)11-4-2-5-12-10-11/h11-12H,2-10H2,1H3/p+2/t11-/m1/s1