4-[6-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine

Systemtic Name: 4-[6-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Openeye Name: 4-[6-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine CAS Name: 4-[[6-[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]-3-pyridin-1-iumyl]sulfonyl]morpholine IUPAC Name: 4-[6-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Traditional Name: 4-[6-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]pyridin-1-ium-3-yl]sulfonylmorpholine Formula: C20H28N4O3S+2 MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C[NH+]1CCN([C@@H](C1)C2=CC=CC=C2)C3=[NH+]C=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C20H26N4O3S/c1-22-9-10-24(19(16-22)17-5-3-2-4-6-17)20-8-7-18(15-21-20)28(25,26)23-11-13-27-14-12-23/h2-8,15,19H,9-14,16H2,1H3/p+2/t19-/m0/s1