(E)-but-2-enedioic acid; N-(2-ethenylpyrrol-1-yl)-N-methyl-pyridin-4-amine

Systemtic Name: (E)-but-2-enedioic acid; N-(2-ethenylpyrrol-1-yl)-N-methyl-pyridin-4-amine Openeye Name: fumaric acid; N-methyl-N-(2-vinylpyrrol-1-yl)pyridin-4-amine CAS Name: (E)-2-butenedioic acid; N-(2-ethenyl-1-pyrrolyl)-N-methyl-4-pyridinamine IUPAC Name: (E)-but-2-enedioic acid; N-(2-ethenylpyrrol-1-yl)-N-methylpyridin-4-amine Traditional Name: fumaric acid; methyl-(4-pyridyl)-(2-vinylpyrrol-1-yl)amine Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=NC=C1)N2C=CC=C2C=C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C1=CC=NC=C1)N2C=CC=C2C=C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C12H13N3.C4H4O4/c1-3-11-5-4-10-15(11)14(2)12-6-8-13-9-7-12;5-3(6)1-2-4(7)8/h3-10H,1H2,2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+