(E)-but-2-enedioic acid; 4,6-dimethyloctan-4-amine

Systemtic Name: (E)-but-2-enedioic acid; 4,6-dimethyloctan-4-amine Openeye Name: 4,6-dimethyloctan-4-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 4,6-dimethyl-4-octanamine IUPAC Name: (E)-but-2-enedioic acid; 4,6-dimethyloctan-4-amine Traditional Name: (1,3-dimethyl-1-propyl-pentyl)amine; fumaric acid Formula: C14H27NO4 MolecularWeight: 273.36848

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(CC(C)CC)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCC(C)(CC(C)CC)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C10H23N.C4H4O4/c1-5-7-10(4,11)8-9(3)6-2;5-3(6)1-2-4(7)8/h9H,5-8,11H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+