2-[[2-[(2-nitropyridin-3-yl)oxymethyl]phenyl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[2-[(2-nitropyridin-3-yl)oxymethyl]phenyl]methyl]isoindole-1,3-dione Openeye Name: 2-[[2-[(2-nitro-3-pyridyl)oxymethyl]phenyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[2-[(2-nitro-3-pyridinyl)oxymethyl]phenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[2-[(2-nitropyridin-3-yl)oxymethyl]phenyl]methyl]isoindole-1,3-dione Traditional Name: 2-[2-[(2-nitro-3-pyridyl)oxymethyl]benzyl]isoindoline-1,3-quinone Formula: C21H15N3O5 MolecularWeight: 389.3609

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3C2=O)COC4=C(N=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3C2=O)COC4=C(N=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O5/c25-20-16-8-3-4-9-17(16)21(26)23(20)12-14-6-1-2-7-15(14)13-29-18-10-5-11-22-19(18)24(27)28/h1-11H,12-13H2