(E)-but-2-enedioic acid; N-[3-(2,3-dihydroindol-1-yl)pyridin-4-yl]ethanamide

Systemtic Name: (E)-but-2-enedioic acid; N-[3-(2,3-dihydroindol-1-yl)pyridin-4-yl]ethanamide Openeye Name: fumaric acid; N-(3-indolin-1-yl-4-pyridyl)acetamide CAS Name: (E)-2-butenedioic acid; N-[3-(2,3-dihydroindol-1-yl)-4-pyridinyl]acetamide IUPAC Name: (E)-but-2-enedioic acid; N-[3-(2,3-dihydroindol-1-yl)pyridin-4-yl]acetamide Traditional Name: fumaric acid; N-(3-indolin-1-yl-4-pyridyl)acetamide Formula: C19H19N3O5 MolecularWeight: 369.37126

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=NC=C1)N2CCC3=CC=CC=C32.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=NC=C1)N2CCC3=CC=CC=C32.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H15N3O.C4H4O4/c1-11(19)17-13-6-8-16-10-15(13)18-9-7-12-4-2-3-5-14(12)18;5-3(6)1-2-4(7)8/h2-6,8,10H,7,9H2,1H3,(H,16,17,19);1-2H,(H,5,6)(H,7,8)/b;2-1+