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

Systemtic Name: N-(5-nitro-2-oxidanyl-phenyl)-1,3-bis(oxidanylidene)-2-propyl-isoindole-5-carboxamide Openeye Name: N-(2-hydroxy-5-nitro-phenyl)-1,3-dioxo-2-propyl-isoindoline-5-carboxamide CAS Name: N-(2-hydroxy-5-nitrophenyl)-1,3-dioxo-2-propyl-5-isoindolecarboxamide IUPAC Name: N-(2-hydroxy-5-nitrophenyl)-1,3-dioxo-2-propylisoindole-5-carboxamide Traditional Name: N-(2-hydroxy-5-nitro-phenyl)-1,3-diketo-2-propyl-isoindoline-5-carboxamide Formula: C18H15N3O6 MolecularWeight: 369.3282

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

CCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C18H15N3O6/c1-2-7-20-17(24)12-5-3-10(8-13(12)18(20)25)16(23)19-14-9-11(21(26)27)4-6-15(14)22/h3-6,8-9,22H,2,7H2,1H3,(H,19,23)