(3R,5R)-1-(4-methoxyphenyl)sulfonyl-3,5-dimethyl-piperazin-4-ium

Systemtic Name: (3R,5R)-1-(4-methoxyphenyl)sulfonyl-3,5-dimethyl-piperazin-4-ium Openeye Name: (3R,5R)-1-(4-methoxyphenyl)sulfonyl-3,5-dimethyl-piperazin-4-ium CAS Name: (3R,5R)-1-(4-methoxyphenyl)sulfonyl-3,5-dimethylpiperazin-4-ium IUPAC Name: (3R,5R)-1-(4-methoxyphenyl)sulfonyl-3,5-dimethylpiperazin-4-ium Traditional Name: (3R,5R)-1-(4-methoxyphenyl)sulfonyl-3,5-dimethyl-piperazin-4-ium Formula: C13H21N2O3S+ MolecularWeight: 285.38244

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC([NH2+]1)C)S(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

C[C@@H]1CN(C[C@H]([NH2+]1)C)S(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C13H20N2O3S/c1-10-8-15(9-11(2)14-10)19(16,17)13-6-4-12(18-3)5-7-13/h4-7,10-11,14H,8-9H2,1-3H3/p+1/t10-,11-/m1/s1