2-azaniumylethylsulfonyl-(3,4-diethoxyphenyl)azanide

Systemtic Name: 2-azaniumylethylsulfonyl-(3,4-diethoxyphenyl)azanide Openeye Name: 2-azaniumylethylsulfonyl-(3,4-diethoxyphenyl)azanide CAS Name: 2-ammonioethylsulfonyl-(3,4-diethoxyphenyl)azanide IUPAC Name: 2-azaniumylethylsulfonyl-(3,4-diethoxyphenyl)azanide Traditional Name: 2-ammonioethylsulfonyl-(3,4-diethoxyphenyl)azanide Formula: C12H20N2O4S MolecularWeight: 288.3632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)[N-]S(=O)(=O)CC[NH3+])OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[N-]S(=O)(=O)CC[NH3+])OCC

InChI

InChI=1S/C12H19N2O4S/c1-3-17-11-6-5-10(9-12(11)18-4-2)14-19(15,16)8-7-13/h5-6,9H,3-4,7-8,13H2,1-2H3/q-1/p+1