1-[[(2R)-oxan-2-yl]methyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazin-1-ium

Systemtic Name: 1-[[(2R)-oxan-2-yl]methyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazin-1-ium Openeye Name: 1-[[(2R)-tetrahydropyran-2-yl]methyl]-4-(2,4,6-trimethylphenyl)sulfonyl-piperazin-1-ium CAS Name: 1-[[(2R)-2-oxanyl]methyl]-4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium IUPAC Name: 1-[[(2R)-oxan-2-yl]methyl]-4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium Traditional Name: 1-mesitylsulfonyl-4-[[(2R)-tetrahydropyran-2-yl]methyl]piperazin-4-ium Formula: C19H31N2O3S+ MolecularWeight: 367.52604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CC[NH+](CC2)CC3CCCCO3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CC[NH+](CC2)C[C@H]3CCCCO3)C

InChI

InChI=1S/C19H30N2O3S/c1-15-12-16(2)19(17(3)13-15)25(22,23)21-9-7-20(8-10-21)14-18-6-4-5-11-24-18/h12-13,18H,4-11,14H2,1-3H3/p+1/t18-/m1/s1