2-bromanyl-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-5-nitro-benzamide

Systemtic Name: 2-bromanyl-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-5-nitro-benzamide Openeye Name: 2-bromo-N-(2-methyl-3-oxazolo[4,5-b]pyridin-2-yl-phenyl)-5-nitro-benzamide CAS Name: 2-bromo-N-[2-methyl-3-(2-oxazolo[4,5-b]pyridinyl)phenyl]-5-nitrobenzamide IUPAC Name: 2-bromo-N-[2-methyl-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]-5-nitrobenzamide Traditional Name: 2-bromo-N-(2-methyl-3-oxazolo[4,5-b]pyridin-2-yl-phenyl)-5-nitro-benzamide Formula: C20H13BrN4O4 MolecularWeight: 453.24562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Br)C3=NC4=C(O3)C=CC=N4

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])Br)C3=NC4=C(O3)C=CC=N4

InChI

InChI=1S/C20H13BrN4O4/c1-11-13(20-24-18-17(29-20)6-3-9-22-18)4-2-5-16(11)23-19(26)14-10-12(25(27)28)7-8-15(14)21/h2-10H,1H3,(H,23,26)