[(3R)-1-(2,5-dimethylphenyl)sulfonylpiperidin-3-yl]methylazanium

Systemtic Name: [(3R)-1-(2,5-dimethylphenyl)sulfonylpiperidin-3-yl]methylazanium Openeye Name: [(3R)-1-(2,5-dimethylphenyl)sulfonyl-3-piperidyl]methylammonium CAS Name: [(3R)-1-(2,5-dimethylphenyl)sulfonyl-3-piperidinyl]methylammonium IUPAC Name: [(3R)-1-(2,5-dimethylphenyl)sulfonylpiperidin-3-yl]methylazanium Traditional Name: [(3R)-1-(2,5-dimethylphenyl)sulfonyl-3-piperidyl]methylammonium Formula: C14H23N2O2S+ MolecularWeight: 283.40962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCCC(C2)C[NH3+]

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCC[C@@H](C2)C[NH3+]

InChI

InChI=1S/C14H22N2O2S/c1-11-5-6-12(2)14(8-11)19(17,18)16-7-3-4-13(9-15)10-16/h5-6,8,13H,3-4,7,9-10,15H2,1-2H3/p+1/t13-/m1/s1