N-[2-(4-methylphenoxy)ethyl]-6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]hexanamide

Systemtic Name: N-[2-(4-methylphenoxy)ethyl]-6-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]hexanamide Openeye Name: N-[2-(4-methylphenoxy)ethyl]-6-(4-nitro-1,3-dioxo-isoindolin-2-yl)hexanamide CAS Name: N-[2-(4-methylphenoxy)ethyl]-6-(4-nitro-1,3-dioxo-2-isoindolyl)hexanamide IUPAC Name: N-[2-(4-methylphenoxy)ethyl]-6-(4-nitro-1,3-dioxoisoindol-2-yl)hexanamide Traditional Name: 6-(1,3-diketo-4-nitro-isoindolin-2-yl)-N-[2-(4-methylphenoxy)ethyl]hexanamide Formula: C23H25N3O6 MolecularWeight: 439.4611

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCNC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)OCCNC(=O)CCCCCN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O6/c1-16-9-11-17(12-10-16)32-15-13-24-20(27)8-3-2-4-14-25-22(28)18-6-5-7-19(26(30)31)21(18)23(25)29/h5-7,9-12H,2-4,8,13-15H2,1H3,(H,24,27)