(E)-but-2-enedioic acid; 2-methyl-1,4-dihydropyridine

Systemtic Name: (E)-but-2-enedioic acid; 2-methyl-1,4-dihydropyridine Openeye Name: fumaric acid; 2-methyl-1,4-dihydropyridine CAS Name: (E)-2-butenedioic acid; 2-methyl-1,4-dihydropyridine IUPAC Name: (E)-but-2-enedioic acid; 2-methyl-1,4-dihydropyridine Traditional Name: fumaric acid; 2-methyl-1,4-dihydropyridine Formula: C10H13NO4 MolecularWeight: 211.21452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC=CN1.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CCC=CN1.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C6H9N.C4H4O4/c1-6-4-2-3-5-7-6;5-3(6)1-2-4(7)8/h3-5,7H,2H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+