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

Systemtic Name: 5-(4-nitrophenoxy)-2-(3-oxidanylpropyl)isoindole-1,3-dione Openeye Name: 2-(3-hydroxypropyl)-5-(4-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-(3-hydroxypropyl)-5-(4-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-(3-hydroxypropyl)-5-(4-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-(3-hydroxypropyl)-5-(4-nitrophenoxy)isoindoline-1,3-quinone Formula: C17H14N2O6 MolecularWeight: 342.30286

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC2=CC3=C(C=C2)C(=O)N(C3=O)CCCO

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC2=CC3=C(C=C2)C(=O)N(C3=O)CCCO

InChI

InChI=1S/C17H14N2O6/c20-9-1-8-18-16(21)14-7-6-13(10-15(14)17(18)22)25-12-4-2-11(3-5-12)19(23)24/h2-7,10,20H,1,8-9H2