2-[1,3-benzodioxol-5-ylsulfonyl(propan-2-yl)amino]ethylazanium

Systemtic Name: 2-[1,3-benzodioxol-5-ylsulfonyl(propan-2-yl)amino]ethylazanium Openeye Name: 2-[1,3-benzodioxol-5-ylsulfonyl(isopropyl)amino]ethylammonium CAS Name: 2-[1,3-benzodioxol-5-ylsulfonyl(propan-2-yl)amino]ethylammonium IUPAC Name: 2-[1,3-benzodioxol-5-ylsulfonyl(propan-2-yl)amino]ethylazanium Traditional Name: 2-[1,3-benzodioxol-5-ylsulfonyl(isopropyl)amino]ethylammonium Formula: C12H19N2O4S+ MolecularWeight: 287.35526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC[NH3+])S(=O)(=O)C1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)N(CC[NH3+])S(=O)(=O)C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C12H18N2O4S/c1-9(2)14(6-5-13)19(15,16)10-3-4-11-12(7-10)18-8-17-11/h3-4,7,9H,5-6,8,13H2,1-2H3/p+1