5-nitro-2-[2-(4-propoxyphenoxy)ethyl]isoindole-1,3-dione

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCCN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O6/c1-2-10-26-14-4-6-15(7-5-14)27-11-9-20-18(22)16-8-3-13(21(24)25)12-17(16)19(20)23/h3-8,12H,2,9-11H2,1H3