2-[2-(2,3-dimethylphenoxy)ethylsulfonyl]ethylazanium

Systemtic Name: 2-[2-(2,3-dimethylphenoxy)ethylsulfonyl]ethylazanium Openeye Name: 2-[2-(2,3-dimethylphenoxy)ethylsulfonyl]ethylammonium CAS Name: 2-[2-(2,3-dimethylphenoxy)ethylsulfonyl]ethylammonium IUPAC Name: 2-[2-(2,3-dimethylphenoxy)ethylsulfonyl]ethylazanium Traditional Name: 2-[2-(2,3-dimethylphenoxy)ethylsulfonyl]ethylammonium Formula: C12H20NO3S+ MolecularWeight: 258.3571

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCCS(=O)(=O)CC[NH3+])C

Isomeric SMILES

CC1=C(C(=CC=C1)OCCS(=O)(=O)CC[NH3+])C

InChI

InChI=1S/C12H19NO3S/c1-10-4-3-5-12(11(10)2)16-7-9-17(14,15)8-6-13/h3-5H,6-9,13H2,1-2H3/p+1