N-(5-bromanyl-3-nitro-pyridin-2-yl)-2-(2-methylpropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide

Systemtic Name: N-(5-bromanyl-3-nitro-pyridin-2-yl)-2-(2-methylpropyl)-1,3-bis(oxidanylidene)isoindole-5-carboxamide Openeye Name: N-(5-bromo-3-nitro-2-pyridyl)-2-isobutyl-1,3-dioxo-isoindoline-5-carboxamide CAS Name: N-(5-bromo-3-nitro-2-pyridinyl)-2-(2-methylpropyl)-1,3-dioxo-5-isoindolecarboxamide IUPAC Name: N-(5-bromo-3-nitropyridin-2-yl)-2-(2-methylpropyl)-1,3-dioxoisoindole-5-carboxamide Traditional Name: N-(5-bromo-3-nitro-2-pyridyl)-2-isobutyl-1,3-diketo-isoindoline-5-carboxamide Formula: C18H15BrN4O5 MolecularWeight: 447.2395

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC=C(C=C3[N+](=O)[O-])Br

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC3=NC=C(C=C3[N+](=O)[O-])Br

InChI

InChI=1S/C18H15BrN4O5/c1-9(2)8-22-17(25)12-4-3-10(5-13(12)18(22)26)16(24)21-15-14(23(27)28)6-11(19)7-20-15/h3-7,9H,8H2,1-2H3,(H,20,21,24)