(E)-but-2-enedioic acid; N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxy-pyridine-3-carboxamide

Systemtic Name: (E)-but-2-enedioic acid; N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxy-pyridine-3-carboxamide Openeye Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxy-pyridine-3-carboxamide; fumaric acid CAS Name: (E)-2-butenedioic acid; N-[(1-ethyl-2-pyrrolidinyl)methyl]-2,6-dimethoxy-3-pyridinecarboxamide IUPAC Name: (E)-but-2-enedioic acid; N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxypyridine-3-carboxamide Traditional Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-2,6-dimethoxy-nicotinamide; fumaric acid Formula: C19H27N3O7 MolecularWeight: 409.43358

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=C(N=C(C=C2)OC)OC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN1CCCC1CNC(=O)C2=C(N=C(C=C2)OC)OC.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H23N3O3.C4H4O4/c1-4-18-9-5-6-11(18)10-16-14(19)12-7-8-13(20-2)17-15(12)21-3;5-3(6)1-2-4(7)8/h7-8,11H,4-6,9-10H2,1-3H3,(H,16,19);1-2H,(H,5,6)(H,7,8)/b;2-1+