3-azanylpropanenitrile; (E)-but-2-enedioic acid

Systemtic Name: 3-azanylpropanenitrile; (E)-but-2-enedioic acid Openeye Name: 3-aminopropanenitrile; fumaric acid CAS Name: 3-aminopropanenitrile; (E)-2-butenedioic acid IUPAC Name: 3-aminopropanenitrile; (E)-but-2-enedioic acid Traditional Name: 3-aminopropionitrile; fumaric acid Formula: C7H10N2O4 MolecularWeight: 186.1653

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Descriptors Computed from Structure

Canonical SMILES:

C(CN)C#N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C(CN)C#N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C4H4O4.C3H6N2/c5-3(6)1-2-4(7)8;4-2-1-3-5/h1-2H,(H,5,6)(H,7,8);1-2,4H2/b2-1+;