(2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-2-phenyl-piperazin-4-ium

Systemtic Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-2-phenyl-piperazin-4-ium Openeye Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-2-phenyl-piperazin-4-ium CAS Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-2-phenylpiperazin-4-ium IUPAC Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-2-phenylpiperazin-4-ium Traditional Name: (2R)-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-methyl-2-phenyl-piperazin-4-ium Formula: C19H23N2O4S+ MolecularWeight: 375.46192

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C[NH+]1CCN([C@@H](C1)C2=CC=CC=C2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C19H22N2O4S/c1-20-9-10-21(17(14-20)15-5-3-2-4-6-15)26(22,23)16-7-8-18-19(13-16)25-12-11-24-18/h2-8,13,17H,9-12,14H2,1H3/p+1/t17-/m0/s1