(E)-but-2-enedioate; 2-(chloromethyl)oxirane

Systemtic Name: (E)-but-2-enedioate; 2-(chloromethyl)oxirane Openeye Name: (E)-but-2-enedioate; 2-(chloromethyl)oxirane CAS Name: (E)-2-butenedioate; 2-(chloromethyl)oxirane IUPAC Name: (E)-but-2-enedioate; 2-(chloromethyl)oxirane Traditional Name: 2-(chloromethyl)oxirane fumarate Formula: C7H7ClO5-2 MolecularWeight: 206.58048

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Descriptors Computed from Structure

Canonical SMILES:

C1C(O1)CCl.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1C(O1)CCl.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/C4H4O4.C3H5ClO/c5-3(6)1-2-4(7)8;4-1-3-2-5-3/h1-2H,(H,5,6)(H,7,8);3H,1-2H2/p-2/b2-1+;