2-(1,3-benzodioxol-5-ylmethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-5-(4-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-5-(4-nitrophenoxy)isoindole-1,3-dione Traditional Name: 5-(4-nitrophenoxy)-2-piperonyl-isoindoline-1,3-quinone Formula: C22H14N2O7 MolecularWeight: 418.35576

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C3=O)C=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C3=O)C=C(C=C4)OC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H14N2O7/c25-21-17-7-6-16(31-15-4-2-14(3-5-15)24(27)28)10-18(17)22(26)23(21)11-13-1-8-19-20(9-13)30-12-29-19/h1-10H,11-12H2