6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methoxy-5-nitro-phenyl)hexanamide

Systemtic Name: 6-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-methoxy-5-nitro-phenyl)hexanamide Openeye Name: 6-(1,3-dioxoisoindolin-2-yl)-N-(2-methoxy-5-nitro-phenyl)hexanamide CAS Name: 6-(1,3-dioxo-2-isoindolyl)-N-(2-methoxy-5-nitrophenyl)hexanamide IUPAC Name: 6-(1,3-dioxoisoindol-2-yl)-N-(2-methoxy-5-nitrophenyl)hexanamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-6-phthalimido-hexanamide Formula: C21H21N3O6 MolecularWeight: 411.40794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

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