2-[(2,5-dimethylphenyl)sulfonyl-propan-2-yl-amino]ethylazanium

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfonyl-propan-2-yl-amino]ethylazanium Openeye Name: 2-[(2,5-dimethylphenyl)sulfonyl-isopropyl-amino]ethylammonium CAS Name: 2-[(2,5-dimethylphenyl)sulfonyl-propan-2-ylamino]ethylammonium IUPAC Name: 2-[(2,5-dimethylphenyl)sulfonyl-propan-2-ylamino]ethylazanium Traditional Name: 2-[(2,5-dimethylphenyl)sulfonyl-isopropyl-amino]ethylammonium Formula: C13H23N2O2S+ MolecularWeight: 271.39892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H22N2O2S/c1-10(2)15(8-7-14)18(16,17)13-9-11(3)5-6-12(13)4/h5-6,9-10H,7-8,14H2,1-4H3/p+1