2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-pentanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methoxy-5-nitro-phenyl)-4-methyl-pentanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(2-methoxy-5-nitro-phenyl)-4-methyl-pentanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-(2-methoxy-5-nitrophenyl)-4-methylpentanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(2-methoxy-5-nitrophenyl)-4-methylpentanamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-4-methyl-2-phthalimido-valeramide Formula: C21H21N3O6 MolecularWeight: 411.40794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21N3O6/c1-12(2)10-17(23-20(26)14-6-4-5-7-15(14)21(23)27)19(25)22-16-11-13(24(28)29)8-9-18(16)30-3/h4-9,11-12,17H,10H2,1-3H3,(H,22,25)