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

Systemtic Name: N-[1,3-bis(oxidanylidene)-2-phenyl-isoindol-5-yl]-4-methoxy-3-nitro-benzamide Openeye Name: N-(1,3-dioxo-2-phenyl-isoindolin-5-yl)-4-methoxy-3-nitro-benzamide CAS Name: N-(1,3-dioxo-2-phenyl-5-isoindolyl)-4-methoxy-3-nitrobenzamide IUPAC Name: N-(1,3-dioxo-2-phenylisoindol-5-yl)-4-methoxy-3-nitrobenzamide Traditional Name: N-(1,3-diketo-2-phenyl-isoindolin-5-yl)-4-methoxy-3-nitro-benzamide Formula: C22H15N3O6 MolecularWeight: 417.371

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N3O6/c1-31-19-10-7-13(11-18(19)25(29)30)20(26)23-14-8-9-16-17(12-14)22(28)24(21(16)27)15-5-3-2-4-6-15/h2-12H,1H3,(H,23,26)