N-[[(3S)-piperidin-1-ium-3-yl]methyl]azepane-1-sulfonamide

Systemtic Name: N-[[(3S)-piperidin-1-ium-3-yl]methyl]azepane-1-sulfonamide Openeye Name: N-[[(3S)-piperidin-1-ium-3-yl]methyl]azepane-1-sulfonamide CAS Name: N-[[(3S)-3-piperidin-1-iumyl]methyl]-1-azepanesulfonamide IUPAC Name: N-[[(3S)-piperidin-1-ium-3-yl]methyl]azepane-1-sulfonamide Traditional Name: N-[[(3S)-piperidin-1-ium-3-yl]methyl]azepane-1-sulfonamide Formula: C12H26N3O2S+ MolecularWeight: 276.41874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)NCC2CCC[NH2+]C2

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)NC[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C12H25N3O2S/c16-18(17,15-8-3-1-2-4-9-15)14-11-12-6-5-7-13-10-12/h12-14H,1-11H2/p+1/t12-/m0/s1