4-nitro-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]isoindole-1,3-dione

Systemtic Name: 4-nitro-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]isoindole-1,3-dione Openeye Name: 4-nitro-2-[[2-(3-pyridyl)pyrrolidin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 4-nitro-2-[[2-(3-pyridinyl)-1-pyrrolidinyl]methyl]isoindole-1,3-dione IUPAC Name: 4-nitro-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]isoindole-1,3-dione Traditional Name: 4-nitro-2-[[2-(3-pyridyl)pyrrolidino]methyl]isoindoline-1,3-quinone Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=CN=CC=C4

Isomeric SMILES

C1CC(N(C1)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-])C4=CN=CC=C4

InChI

InChI=1S/C18H16N4O4/c23-17-13-5-1-6-15(22(25)26)16(13)18(24)21(17)11-20-9-3-7-14(20)12-4-2-8-19-10-12/h1-2,4-6,8,10,14H,3,7,9,11H2