(Z)-but-2-enedioic acid; 2-pyridin-4-yl-1,3-dihydroisoindole

Systemtic Name: (Z)-but-2-enedioic acid; 2-pyridin-4-yl-1,3-dihydroisoindole Openeye Name: maleic acid; 2-(4-pyridyl)isoindoline CAS Name: (Z)-2-butenedioic acid; 2-pyridin-4-yl-1,3-dihydroisoindole IUPAC Name: (Z)-but-2-enedioic acid; 2-pyridin-4-yl-1,3-dihydroisoindole Traditional Name: maleic acid; 2-(4-pyridyl)isoindoline Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2CN1C3=CC=NC=C3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1C2=CC=CC=C2CN1C3=CC=NC=C3.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C13H12N2.C4H4O4/c1-2-4-12-10-15(9-11(12)3-1)13-5-7-14-8-6-13;5-3(6)1-2-4(7)8/h1-8H,9-10H2;1-2H,(H,5,6)(H,7,8)/b;2-1-