(2R)-2-[4-(phenylmethyl)sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: (2R)-2-[4-(phenylmethyl)sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: (2R)-2-(4-benzylsulfonylpiperazin-1-ium-1-yl)propanamide CAS Name: (2R)-2-[4-(phenylmethyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: (2R)-2-(4-benzylsulfonylpiperazin-1-ium-1-yl)propanamide Traditional Name: (2R)-2-(4-benzylsulfonylpiperazin-1-ium-1-yl)propionamide Formula: C14H22N3O3S+ MolecularWeight: 312.40778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)[NH+]1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)N)[NH+]1CCN(CC1)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C14H21N3O3S/c1-12(14(15)18)16-7-9-17(10-8-16)21(19,20)11-13-5-3-2-4-6-13/h2-6,12H,7-11H2,1H3,(H2,15,18)/p+1/t12-/m1/s1