5-[1-(2-hydroxyethyl)-3-pyridin-4-yl-pyrazol-4-yl]-2-(2-methoxyethyl)isoindole-1,3-dione

Systemtic Name: 5-[1-(2-hydroxyethyl)-3-pyridin-4-yl-pyrazol-4-yl]-2-(2-methoxyethyl)isoindole-1,3-dione Openeye Name: 5-[1-(2-hydroxyethyl)-3-(4-pyridyl)pyrazol-4-yl]-2-(2-methoxyethyl)isoindoline-1,3-dione CAS Name: 5-[1-(2-hydroxyethyl)-3-pyridin-4-yl-4-pyrazolyl]-2-(2-methoxyethyl)isoindole-1,3-dione IUPAC Name: 5-[1-(2-hydroxyethyl)-3-pyridin-4-ylpyrazol-4-yl]-2-(2-methoxyethyl)isoindole-1,3-dione Traditional Name: 5-[1-(2-hydroxyethyl)-3-(4-pyridyl)pyrazol-4-yl]-2-(2-methoxyethyl)isoindoline-1,3-quinone Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=CN(N=C3C4=CC=NC=C4)CCO

Isomeric SMILES

COCCN1C(=O)C2=C(C1=O)C=C(C=C2)C3=CN(N=C3C4=CC=NC=C4)CCO

InChI

InChI=1S/C21H20N4O4/c1-29-11-9-25-20(27)16-3-2-15(12-17(16)21(25)28)18-13-24(8-10-26)23-19(18)14-4-6-22-7-5-14/h2-7,12-13,26H,8-11H2,1H3