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

Systemtic Name: 3-nitro-N-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(4-nitrophenyl)methyl]benzamide Openeye Name: 3-nitro-N-(4-nitro-1,3-dioxo-isoindolin-2-yl)-N-[(4-nitrophenyl)methyl]benzamide CAS Name: 3-nitro-N-(4-nitro-1,3-dioxo-2-isoindolyl)-N-[(4-nitrophenyl)methyl]benzamide IUPAC Name: 3-nitro-N-(4-nitro-1,3-dioxoisoindol-2-yl)-N-[(4-nitrophenyl)methyl]benzamide Traditional Name: N-(1,3-diketo-4-nitro-isoindolin-2-yl)-3-nitro-N-(4-nitrobenzyl)benzamide Formula: C22H13N5O9 MolecularWeight: 491.36672

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N(CC2=CC=C(C=C2)[N+](=O)[O-])N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)N(CC2=CC=C(C=C2)[N+](=O)[O-])N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H13N5O9/c28-20(14-3-1-4-16(11-14)26(33)34)23(12-13-7-9-15(10-8-13)25(31)32)24-21(29)17-5-2-6-18(27(35)36)19(17)22(24)30/h1-11H,12H2