2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethanamine

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonyl-ethanamine Openeye Name: 2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethanamine CAS Name: 2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethanamine IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-thiophen-2-ylsulfonylethanamine Traditional Name: [2-(1,3-benzodioxol-5-yl)-2-(2-thienylsulfonyl)ethyl]amine Formula: C13H13NO4S2 MolecularWeight: 311.37662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(CN)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(CN)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C13H13NO4S2/c14-7-12(20(15,16)13-2-1-5-19-13)9-3-4-10-11(6-9)18-8-17-10/h1-6,12H,7-8,14H2