(E)-2-ethylsulfinylbut-2-enedioate; N-methylmethanamine

Systemtic Name: (E)-2-ethylsulfinylbut-2-enedioate; N-methylmethanamine Openeye Name: (E)-2-ethylsulfinylbut-2-enedioate; N-methylmethanamine CAS Name: (E)-2-ethylsulfinyl-2-butenedioate; N-methylmethanamine IUPAC Name: (E)-2-ethylsulfinylbut-2-enedioate; N-methylmethanamine Traditional Name: dimethylamine; (E)-2-ethylsulfinylbut-2-enedioate Formula: C8H13NO5S-2 MolecularWeight: 235.25752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C(=CC(=O)[O-])C(=O)[O-].CNC

Isomeric SMILES

CCS(=O)/C(=C/C(=O)[O-])/C(=O)[O-].CNC

InChI

InChI=1S/C6H8O5S.C2H7N/c1-2-12(11)4(6(9)10)3-5(7)8;1-3-2/h3H,2H2,1H3,(H,7,8)(H,9,10);3H,1-2H3/p-2/b4-3+;