N-[4-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]phenyl]butanamide

Systemtic Name: N-[4-[2-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]ethanoyl]phenyl]butanamide Openeye Name: N-[4-[2-(4-nitro-1,3-dioxo-isoindolin-2-yl)acetyl]phenyl]butanamide CAS Name: N-[4-[2-(4-nitro-1,3-dioxo-2-isoindolyl)-1-oxoethyl]phenyl]butanamide IUPAC Name: N-[4-[2-(4-nitro-1,3-dioxoisoindol-2-yl)acetyl]phenyl]butanamide Traditional Name: N-[4-[2-(1,3-diketo-4-nitro-isoindolin-2-yl)acetyl]phenyl]butyramide Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O6/c1-2-4-17(25)21-13-9-7-12(8-10-13)16(24)11-22-19(26)14-5-3-6-15(23(28)29)18(14)20(22)27/h3,5-10H,2,4,11H2,1H3,(H,21,25)