3-bromanyl-1,7,7-trimethyl-N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxidanylidene-bicyclo[2.2.1]heptane-4-carboxamide

Systemtic Name: 3-bromanyl-1,7,7-trimethyl-N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxidanylidene-bicyclo[2.2.1]heptane-4-carboxamide Openeye Name: 2-bromo-4,7,7-trimethyl-N-(6-nitro-1,3-benzodioxol-5-yl)-3-oxo-norbornane-1-carboxamide CAS Name: 3-bromo-1,7,7-trimethyl-N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxo-4-bicyclo[2.2.1]heptanecarboxamide IUPAC Name: 3-bromo-1,7,7-trimethyl-N-(6-nitro-1,3-benzodioxol-5-yl)-2-oxobicyclo[2.2.1]heptane-4-carboxamide Traditional Name: 2-bromo-3-keto-4,7,7-trimethyl-N-(6-nitro-1,3-benzodioxol-5-yl)norbornane-1-carboxamide Formula: C18H19BrN2O6 MolecularWeight: 439.25726

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(C(C2=O)Br)C(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCO4)C)C

Isomeric SMILES

CC1(C2(CCC1(C(C2=O)Br)C(=O)NC3=CC4=C(C=C3[N+](=O)[O-])OCO4)C)C

InChI

InChI=1S/C18H19BrN2O6/c1-16(2)17(3)4-5-18(16,13(19)14(17)22)15(23)20-9-6-11-12(27-8-26-11)7-10(9)21(24)25/h6-7,13H,4-5,8H2,1-3H3,(H,20,23)