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

Systemtic Name: N-[(4-chloranyl-2-nitro-phenyl)methyl]-2-nitro-N-[4-nitro-1,3-bis(oxidanylidene)isoindol-2-yl]benzamide Openeye Name: N-[(4-chloro-2-nitro-phenyl)methyl]-2-nitro-N-(4-nitro-1,3-dioxo-isoindolin-2-yl)benzamide CAS Name: N-[(4-chloro-2-nitrophenyl)methyl]-2-nitro-N-(4-nitro-1,3-dioxo-2-isoindolyl)benzamide IUPAC Name: N-[(4-chloro-2-nitrophenyl)methyl]-2-nitro-N-(4-nitro-1,3-dioxoisoindol-2-yl)benzamide Traditional Name: N-(4-chloro-2-nitro-benzyl)-N-(1,3-diketo-4-nitro-isoindolin-2-yl)-2-nitro-benzamide Formula: C22H12ClN5O9 MolecularWeight: 525.81178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H12ClN5O9/c23-13-9-8-12(18(10-13)28(36)37)11-24(20(29)14-4-1-2-6-16(14)26(32)33)25-21(30)15-5-3-7-17(27(34)35)19(15)22(25)31/h1-10H,11H2