5-bromanyl-N-pyridin-4-yl-indol-1-amine; (E)-but-2-enedioic acid

Systemtic Name: 5-bromanyl-N-pyridin-4-yl-indol-1-amine; (E)-but-2-enedioic acid Openeye Name: 5-bromo-N-(4-pyridyl)indol-1-amine; fumaric acid CAS Name: 5-bromo-N-pyridin-4-yl-1-indolamine; (E)-2-butenedioic acid IUPAC Name: 5-bromo-N-pyridin-4-ylindol-1-amine; (E)-but-2-enedioic acid Traditional Name: (5-bromoindol-1-yl)-(4-pyridyl)amine; fumaric acid Formula: C17H14BrN3O4 MolecularWeight: 404.21476

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN2NC3=CC=NC=C3)C=C1Br.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC2=C(C=CN2NC3=CC=NC=C3)C=C1Br.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C13H10BrN3.C4H4O4/c14-11-1-2-13-10(9-11)5-8-17(13)16-12-3-6-15-7-4-12;5-3(6)1-2-4(7)8/h1-9H,(H,15,16);1-2H,(H,5,6)(H,7,8)/b;2-1+