1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[[(2R)-oxan-2-yl]methyl]piperazin-4-ium

Systemtic Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[[(2R)-oxan-2-yl]methyl]piperazin-4-ium Openeye Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperazin-4-ium CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[[(2R)-2-oxanyl]methyl]piperazin-4-ium IUPAC Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[[(2R)-oxan-2-yl]methyl]piperazin-4-ium Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperazin-4-ium Formula: C18H27N2O5S+ MolecularWeight: 383.48238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

C1CCO[C@H](C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C18H26N2O5S/c21-26(22,16-4-5-17-18(13-16)25-12-11-24-17)20-8-6-19(7-9-20)14-15-3-1-2-10-23-15/h4-5,13,15H,1-3,6-12,14H2/p+1/t15-/m1/s1