1-(2-nitrophenyl)sulfonyl-4-[[(2R)-oxan-2-yl]methyl]piperazin-4-ium

Systemtic Name: 1-(2-nitrophenyl)sulfonyl-4-[[(2R)-oxan-2-yl]methyl]piperazin-4-ium Openeye Name: 1-(2-nitrophenyl)sulfonyl-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperazin-4-ium CAS Name: 1-(2-nitrophenyl)sulfonyl-4-[[(2R)-2-oxanyl]methyl]piperazin-4-ium IUPAC Name: 1-(2-nitrophenyl)sulfonyl-4-[[(2R)-oxan-2-yl]methyl]piperazin-4-ium Traditional Name: 1-(2-nitrophenyl)sulfonyl-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperazin-4-ium Formula: C16H24N3O5S+ MolecularWeight: 370.44386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCO[C@H](C1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O5S/c20-19(21)15-6-1-2-7-16(15)25(22,23)18-10-8-17(9-11-18)13-14-5-3-4-12-24-14/h1-2,6-7,14H,3-5,8-13H2/p+1/t14-/m1/s1