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

Systemtic Name: N-(4-hydroxyphenyl)-4-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide Openeye Name: N-(4-hydroxyphenyl)-4-(5-nitro-1,3-dioxo-isoindolin-2-yl)benzamide CAS Name: N-(4-hydroxyphenyl)-4-(5-nitro-1,3-dioxo-2-isoindolyl)benzamide IUPAC Name: N-(4-hydroxyphenyl)-4-(5-nitro-1,3-dioxoisoindol-2-yl)benzamide Traditional Name: 4-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-(4-hydroxyphenyl)benzamide Formula: C21H13N3O6 MolecularWeight: 403.34442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)O)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CC=C(C=C2)O)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H13N3O6/c25-16-8-3-13(4-9-16)22-19(26)12-1-5-14(6-2-12)23-20(27)17-10-7-15(24(29)30)11-18(17)21(23)28/h1-11,25H,(H,22,26)