N-(2-bromanyl-5-nitro-phenyl)-1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxamide

Systemtic Name: N-(2-bromanyl-5-nitro-phenyl)-1,7,7-trimethyl-2-oxidanylidene-3-oxabicyclo[2.2.1]heptane-4-carboxamide Openeye Name: N-(2-bromo-5-nitro-phenyl)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxamide CAS Name: N-(2-bromo-5-nitrophenyl)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxamide IUPAC Name: N-(2-bromo-5-nitrophenyl)-1,7,7-trimethyl-2-oxo-3-oxabicyclo[2.2.1]heptane-4-carboxamide Traditional Name: N-(2-bromo-5-nitro-phenyl)-2-keto-1,7,7-trimethyl-3-oxabicyclo[2.2.1]heptane-4-carboxamide Formula: C16H17BrN2O5 MolecularWeight: 397.22058

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(OC2=O)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Br)C)C

Isomeric SMILES

CC1(C2(CCC1(OC2=O)C(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])Br)C)C

InChI

InChI=1S/C16H17BrN2O5/c1-14(2)15(3)6-7-16(14,24-13(15)21)12(20)18-11-8-9(19(22)23)4-5-10(11)17/h4-5,8H,6-7H2,1-3H3,(H,18,20)