(E)-but-2-enedioic acid; methylaminomethanetriol

Systemtic Name: (E)-but-2-enedioic acid; methylaminomethanetriol Openeye Name: fumaric acid; methylaminomethanetriol CAS Name: (E)-2-butenedioic acid; methylaminomethanetriol IUPAC Name: (E)-but-2-enedioic acid; methylaminomethanetriol Traditional Name: fumaric acid; methylaminomethanetriol Formula: C6H11NO7 MolecularWeight: 209.15404

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Descriptors Computed from Structure

Canonical SMILES:

CNC(O)(O)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CNC(O)(O)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C4H4O4.C2H7NO3/c5-3(6)1-2-4(7)8;1-3-2(4,5)6/h1-2H,(H,5,6)(H,7,8);3-6H,1H3/b2-1+;