1-[3-oxidanylidene-3-[4-(2-pyridin-2-ylpyridin-4-yl)carbonylpiperazin-1-yl]propyl]pyrrole-2,5-dione

Systemtic Name: 1-[3-oxidanylidene-3-[4-(2-pyridin-2-ylpyridin-4-yl)carbonylpiperazin-1-yl]propyl]pyrrole-2,5-dione Openeye Name: 1-[3-oxo-3-[4-[2-(2-pyridyl)pyridine-4-carbonyl]piperazin-1-yl]propyl]pyrrole-2,5-dione CAS Name: 1-[3-oxo-3-[4-[oxo-[2-(2-pyridinyl)-4-pyridinyl]methyl]-1-piperazinyl]propyl]pyrrole-2,5-dione IUPAC Name: 1-[3-oxo-3-[4-(2-pyridin-2-ylpyridine-4-carbonyl)piperazin-1-yl]propyl]pyrrole-2,5-dione Traditional Name: 1-[3-keto-3-[4-[2-(2-pyridyl)isonicotinoyl]piperazino]propyl]-3-pyrroline-2,5-quinone Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCN2C(=O)C=CC2=O)C(=O)C3=CC(=NC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1C(=O)CCN2C(=O)C=CC2=O)C(=O)C3=CC(=NC=C3)C4=CC=CC=N4

InChI

InChI=1S/C22H21N5O4/c28-19(7-10-27-20(29)4-5-21(27)30)25-11-13-26(14-12-25)22(31)16-6-9-24-18(15-16)17-3-1-2-8-23-17/h1-6,8-9,15H,7,10-14H2