2-[[1-(4-nitrophenyl)piperidin-4-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[1-(4-nitrophenyl)piperidin-4-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[1-(4-nitrophenyl)-4-piperidyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[1-(4-nitrophenyl)-4-piperidinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[1-(4-nitrophenyl)piperidin-4-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[1-(4-nitrophenyl)-4-piperidyl]methyl]isoindoline-1,3-quinone Formula: C20H19N3O4 MolecularWeight: 365.38256

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1CN2C(=O)C3=CC=CC=C3C2=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H19N3O4/c24-19-17-3-1-2-4-18(17)20(25)22(19)13-14-9-11-21(12-10-14)15-5-7-16(8-6-15)23(26)27/h1-8,14H,9-13H2