(E)-but-2-enedioic acid; 2-chloranyl-N-(2-chloroethyl)-N-methyl-ethanamine

Systemtic Name: (E)-but-2-enedioic acid; 2-chloranyl-N-(2-chloroethyl)-N-methyl-ethanamine Openeye Name: 2-chloro-N-(2-chloroethyl)-N-methyl-ethanamine; fumaric acid CAS Name: (E)-2-butenedioic acid; 2-chloro-N-(2-chloroethyl)-N-methylethanamine IUPAC Name: (E)-but-2-enedioic acid; 2-chloro-N-(2-chloroethyl)-N-methylethanamine Traditional Name: bis(2-chloroethyl)-methyl-amine; fumaric acid Formula: C9H15Cl2NO4 MolecularWeight: 272.1257

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCl)CCCl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(CCCl)CCCl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C5H11Cl2N.C4H4O4/c1-8(4-2-6)5-3-7;5-3(6)1-2-4(7)8/h2-5H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+