1,1-bis(chloranyl)ethene; (E)-but-2-enedioic acid; prop-2-enenitrile

Systemtic Name: 1,1-bis(chloranyl)ethene; (E)-but-2-enedioic acid; prop-2-enenitrile Openeye Name: 1,1-dichloroethylene; fumaric acid; prop-2-enenitrile CAS Name: (E)-2-butenedioic acid; 1,1-dichloroethene; 2-propenenitrile IUPAC Name: (E)-but-2-enedioic acid; 1,1-dichloroethene; prop-2-enenitrile Traditional Name: acrylonitrile; 1,1-dichloroethylene; fumaric acid Formula: C9H9Cl2NO4 MolecularWeight: 266.07806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C=CC#N.C=C(Cl)Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C4H4O4.C3H3N.C2H2Cl2/c5-3(6)1-2-4(7)8;1-2-3-4;1-2(3)4/h1-2H,(H,5,6)(H,7,8);2H,1H2;1H2/b2-1+;;