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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-3-[5-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide Openeye Name: N-[(4-methoxyphenyl)methyl]-3-(5-nitro-1,3-dioxo-isoindolin-2-yl)benzamide CAS Name: N-[(4-methoxyphenyl)methyl]-3-(5-nitro-1,3-dioxo-2-isoindolyl)benzamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-3-(5-nitro-1,3-dioxoisoindol-2-yl)benzamide Traditional Name: 3-(1,3-diketo-5-nitro-isoindolin-2-yl)-N-p-anisyl-benzamide Formula: C23H17N3O6 MolecularWeight: 431.39758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C2=CC(=CC=C2)N3C(=O)C4=C(C3=O)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O6/c1-32-18-8-5-14(6-9-18)13-24-21(27)15-3-2-4-16(11-15)25-22(28)19-10-7-17(26(30)31)12-20(19)23(25)29/h2-12H,13H2,1H3,(H,24,27)