N-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(4-methylphenyl)-2,4-dinitro-benzamide

Systemtic Name: N-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-N-(4-methylphenyl)-2,4-dinitro-benzamide Openeye Name: N-[(1,3-dioxoisoindolin-2-yl)methyl]-2,4-dinitro-N-(p-tolyl)benzamide CAS Name: N-[(1,3-dioxo-2-isoindolyl)methyl]-N-(4-methylphenyl)-2,4-dinitrobenzamide IUPAC Name: N-[(1,3-dioxoisoindol-2-yl)methyl]-N-(4-methylphenyl)-2,4-dinitrobenzamide Traditional Name: 2,4-dinitro-N-(phthalimidomethyl)-N-(p-tolyl)benzamide Formula: C23H16N4O7 MolecularWeight: 460.39574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CN2C(=O)C3=CC=CC=C3C2=O)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)N(CN2C(=O)C3=CC=CC=C3C2=O)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O7/c1-14-6-8-15(9-7-14)24(13-25-21(28)17-4-2-3-5-18(17)22(25)29)23(30)19-11-10-16(26(31)32)12-20(19)27(33)34/h2-12H,13H2,1H3