(E)-but-2-enedioic acid; N'-(4-chlorophenyl)ethane-1,2-diamine

Systemtic Name: (E)-but-2-enedioic acid; N'-(4-chlorophenyl)ethane-1,2-diamine Openeye Name: N'-(4-chlorophenyl)ethane-1,2-diamine; fumaric acid CAS Name: (E)-2-butenedioic acid; N'-(4-chlorophenyl)ethane-1,2-diamine IUPAC Name: (E)-but-2-enedioic acid; N'-(4-chlorophenyl)ethane-1,2-diamine Traditional Name: 2-aminoethyl-(4-chlorophenyl)amine; fumaric acid Formula: C12H15ClN2O4 MolecularWeight: 286.7115

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NCCN)Cl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1NCCN)Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C8H11ClN2.C4H4O4/c9-7-1-3-8(4-2-7)11-6-5-10;5-3(6)1-2-4(7)8/h1-4,11H,5-6,10H2;1-2H,(H,5,6)(H,7,8)/b;2-1+