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

Systemtic Name: (E)-but-2-enedioic acid; cyclohexanecarbonitrile Openeye Name: cyclohexanecarbonitrile; fumaric acid CAS Name: (E)-2-butenedioic acid; cyclohexanecarbonitrile IUPAC Name: (E)-but-2-enedioic acid; cyclohexanecarbonitrile Traditional Name: cyclohexanecarbonitrile; fumaric acid Formula: C11H15NO4 MolecularWeight: 225.2411

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C#N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)C#N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C7H11N.C4H4O4/c8-6-7-4-2-1-3-5-7;5-3(6)1-2-4(7)8/h7H,1-5H2;1-2H,(H,5,6)(H,7,8)/b;2-1+