N-(5-nitro-2-oxidanyl-phenyl)-1,3-bis(oxidanylidene)-2-(2-phenylphenyl)isoindole-5-carboxamide

Systemtic Name: N-(5-nitro-2-oxidanyl-phenyl)-1,3-bis(oxidanylidene)-2-(2-phenylphenyl)isoindole-5-carboxamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)-1,3-dioxo-2-(2-phenylphenyl)isoindoline-5-carboxamide CAS Name: N-(2-hydroxy-5-nitrophenyl)-1,3-dioxo-2-(2-phenylphenyl)-5-isoindolecarboxamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)-1,3-dioxo-2-(2-phenylphenyl)isoindole-5-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)-1,3-diketo-2-(2-phenylphenyl)isoindoline-5-carboxamide Formula: C27H17N3O6 MolecularWeight: 479.44038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)NC5=C(C=CC(=C5)[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2N3C(=O)C4=C(C3=O)C=C(C=C4)C(=O)NC5=C(C=CC(=C5)[N+](=O)[O-])O

InChI

InChI=1S/C27H17N3O6/c31-24-13-11-18(30(35)36)15-22(24)28-25(32)17-10-12-20-21(14-17)27(34)29(26(20)33)23-9-5-4-8-19(23)16-6-2-1-3-7-16/h1-15,31H,(H,28,32)