(2R)-2-[2-(4-tert-butylphenyl)sulfonylethyl]piperidin-1-ium

Systemtic Name: (2R)-2-[2-(4-tert-butylphenyl)sulfonylethyl]piperidin-1-ium Openeye Name: (2R)-2-[2-(4-tert-butylphenyl)sulfonylethyl]piperidin-1-ium CAS Name: (2R)-2-[2-(4-tert-butylphenyl)sulfonylethyl]piperidin-1-ium IUPAC Name: (2R)-2-[2-(4-tert-butylphenyl)sulfonylethyl]piperidin-1-ium Traditional Name: (2R)-2-[2-(4-tert-butylphenyl)sulfonylethyl]piperidin-1-ium Formula: C17H28NO2S+ MolecularWeight: 310.47472

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)CCC2CCCC[NH2+]2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)CC[C@H]2CCCC[NH2+]2

InChI

InChI=1S/C17H27NO2S/c1-17(2,3)14-7-9-16(10-8-14)21(19,20)13-11-15-6-4-5-12-18-15/h7-10,15,18H,4-6,11-13H2,1-3H3/p+1/t15-/m1/s1