(E)-but-2-enedioate; 1H-imidazol-1-ium

Systemtic Name: (E)-but-2-enedioate; 1H-imidazol-1-ium Openeye Name: (E)-but-2-enedioate; 1H-imidazol-1-ium CAS Name: (E)-2-butenedioate; 1H-imidazol-1-ium IUPAC Name: (E)-but-2-enedioate; 1H-imidazol-1-ium Traditional Name: 1H-imidazol-1-ium fumarate Formula: C10H12N4O4 MolecularWeight: 252.22668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C[NH2+]1.C1=CN=C[NH2+]1.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CN=C[NH2+]1.C1=CN=C[NH2+]1.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C4H4O4.2C3H4N2/c5-3(6)1-2-4(7)8;2*1-2-5-3-4-1/h1-2H,(H,5,6)(H,7,8);2*1-3H,(H,4,5)/b2-1+;;