(E)-but-2-enedioic acid; 6-fluoranyl-N-pyridin-4-yl-1H-indol-3-amine

Systemtic Name: (E)-but-2-enedioic acid; 6-fluoranyl-N-pyridin-4-yl-1H-indol-3-amine Openeye Name: 6-fluoro-N-(4-pyridyl)-1H-indol-3-amine; fumaric acid CAS Name: (E)-2-butenedioic acid; 6-fluoro-N-pyridin-4-yl-1H-indol-3-amine IUPAC Name: (E)-but-2-enedioic acid; 6-fluoro-N-pyridin-4-yl-1H-indol-3-amine Traditional Name: (6-fluoro-1H-indol-3-yl)-(4-pyridyl)amine; fumaric acid Formula: C17H14FN3O4 MolecularWeight: 343.309163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)NC=C2NC3=CC=NC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1F)NC=C2NC3=CC=NC=C3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C13H10FN3.C4H4O4/c14-9-1-2-11-12(7-9)16-8-13(11)17-10-3-5-15-6-4-10;5-3(6)1-2-4(7)8/h1-8,16H,(H,15,17);1-2H,(H,5,6)(H,7,8)/b;2-1+