2-[1,3-benzodioxol-5-ylsulfonyl(tert-butyl)amino]ethylazanium

Systemtic Name: 2-[1,3-benzodioxol-5-ylsulfonyl(tert-butyl)amino]ethylazanium Openeye Name: 2-[1,3-benzodioxol-5-ylsulfonyl(tert-butyl)amino]ethylammonium CAS Name: 2-[1,3-benzodioxol-5-ylsulfonyl(tert-butyl)amino]ethylammonium IUPAC Name: 2-[1,3-benzodioxol-5-ylsulfonyl(tert-butyl)amino]ethylazanium Traditional Name: 2-[1,3-benzodioxol-5-ylsulfonyl(tert-butyl)amino]ethylammonium Formula: C13H21N2O4S+ MolecularWeight: 301.38184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4S/c1-13(2,3)15(7-6-14)20(16,17)10-4-5-11-12(8-10)19-9-18-11/h4-5,8H,6-7,9,14H2,1-3H3/p+1