(E)-but-2-enedioic acid; N-propyl-N-pyrazol-1-yl-pyridin-4-amine

Systemtic Name: (E)-but-2-enedioic acid; N-propyl-N-pyrazol-1-yl-pyridin-4-amine Openeye Name: fumaric acid; N-propyl-N-pyrazol-1-yl-pyridin-4-amine CAS Name: (E)-2-butenedioic acid; N-propyl-N-(1-pyrazolyl)-4-pyridinamine IUPAC Name: (E)-but-2-enedioic acid; N-propyl-N-pyrazol-1-ylpyridin-4-amine Traditional Name: fumaric acid; propyl-pyrazol-1-yl-(4-pyridyl)amine Formula: C15H18N4O4 MolecularWeight: 318.32782

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=NC=C1)N2C=CC=N2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCCN(C1=CC=NC=C1)N2C=CC=N2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H14N4.C4H4O4/c1-2-9-14(15-10-3-6-13-15)11-4-7-12-8-5-11;5-3(6)1-2-4(7)8/h3-8,10H,2,9H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+