2-[2-(4-nitrophenyl)ethoxy]-3-oxidanyl-4,5-dipentoxy-3H-isoindol-1-one

Systemtic Name: 2-[2-(4-nitrophenyl)ethoxy]-3-oxidanyl-4,5-dipentoxy-3H-isoindol-1-one Openeye Name: 3-hydroxy-2-[2-(4-nitrophenyl)ethoxy]-4,5-dipentoxy-isoindolin-1-one CAS Name: 3-hydroxy-2-[2-(4-nitrophenyl)ethoxy]-4,5-dipentoxy-3H-isoindol-1-one IUPAC Name: 3-hydroxy-2-[2-(4-nitrophenyl)ethoxy]-4,5-dipentoxy-3H-isoindol-1-one Traditional Name: 4,5-diamoxy-3-hydroxy-2-[2-(4-nitrophenyl)ethoxy]isoindolin-1-one Formula: C26H34N2O7 MolecularWeight: 486.55736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C2=C(C=C1)C(=O)N(C2O)OCCC3=CC=C(C=C3)[N+](=O)[O-])OCCCCC

Isomeric SMILES

CCCCCOC1=C(C2=C(C=C1)C(=O)N(C2O)OCCC3=CC=C(C=C3)[N+](=O)[O-])OCCCCC

InChI

InChI=1S/C26H34N2O7/c1-3-5-7-16-33-22-14-13-21-23(24(22)34-17-8-6-4-2)26(30)27(25(21)29)35-18-15-19-9-11-20(12-10-19)28(31)32/h9-14,26,30H,3-8,15-18H2,1-2H3