2-[4-(2-methoxy-5-nitro-phenoxy)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(2-methoxy-5-nitro-phenoxy)butyl]isoindole-1,3-dione Openeye Name: 2-[4-(2-methoxy-5-nitro-phenoxy)butyl]isoindoline-1,3-dione CAS Name: 2-[4-(2-methoxy-5-nitrophenoxy)butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(2-methoxy-5-nitrophenoxy)butyl]isoindole-1,3-dione Traditional Name: 2-[4-(2-methoxy-5-nitro-phenoxy)butyl]isoindoline-1,3-quinone Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H18N2O6/c1-26-16-9-8-13(21(24)25)12-17(16)27-11-5-4-10-20-18(22)14-6-2-3-7-15(14)19(20)23/h2-3,6-9,12H,4-5,10-11H2,1H3