(E)-but-2-enedioic acid; 2-chloranyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine

Systemtic Name: (E)-but-2-enedioic acid; 2-chloranyl-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine Openeye Name: 2-chloro-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine; fumaric acid CAS Name: (E)-2-butenedioic acid; 2-chloro-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine IUPAC Name: (E)-but-2-enedioic acid; 2-chloro-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine Traditional Name: 2-chloro-5-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)pyridine; fumaric acid Formula: C15H17ClN2O4 MolecularWeight: 324.75948

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=CC1)C2=CN=C(C=C2)Cl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN1CCC(=CC1)C2=CN=C(C=C2)Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H13ClN2.C4H4O4/c1-14-6-4-9(5-7-14)10-2-3-11(12)13-8-10;5-3(6)1-2-4(7)8/h2-4,8H,5-7H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+