2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-phenylmethoxyphenyl)ethanamide

Systemtic Name: 2-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-phenylmethoxyphenyl)ethanamide Openeye Name: N-(4-benzyloxyphenyl)-2-(5-nitro-1,3-dioxo-isoindolin-2-yl)acetamide CAS Name: 2-(5-nitro-1,3-dioxo-2-isoindolyl)-N-(4-phenylmethoxyphenyl)acetamide IUPAC Name: 2-(5-nitro-1,3-dioxoisoindol-2-yl)-N-(4-phenylmethoxyphenyl)acetamide Traditional Name: N-(4-benzoxyphenyl)-2-(1,3-diketo-5-nitro-isoindolin-2-yl)acetamide Formula: C23H17N3O6 MolecularWeight: 431.39758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)CN3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O6/c27-21(13-25-22(28)19-11-8-17(26(30)31)12-20(19)23(25)29)24-16-6-9-18(10-7-16)32-14-15-4-2-1-3-5-15/h1-12H,13-14H2,(H,24,27)