6-bromanyl-1,5,5-trimethyl-N'-(4-nitrophenyl)carbonyl-bicyclo[2.1.1]hexane-4-carbohydrazide

Systemtic Name: 6-bromanyl-1,5,5-trimethyl-N'-(4-nitrophenyl)carbonyl-bicyclo[2.1.1]hexane-4-carbohydrazide Openeye Name: 6-bromo-1,5,5-trimethyl-N'-(4-nitrobenzoyl)bicyclo[2.1.1]hexane-4-carbohydrazide CAS Name: 6-bromo-1,5,5-trimethyl-N'-[(4-nitrophenyl)-oxomethyl]-4-bicyclo[2.1.1]hexanecarbohydrazide IUPAC Name: 6-bromo-1,5,5-trimethyl-N'-(4-nitrobenzoyl)bicyclo[2.1.1]hexane-4-carbohydrazide Traditional Name: 6-bromo-1,5,5-trimethyl-N'-(4-nitrobenzoyl)bicyclo[2.1.1]hexane-4-carbohydrazide Formula: C17H20BrN3O4 MolecularWeight: 410.2624

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(C2Br)C(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1(C2(CCC1(C2Br)C(=O)NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C17H20BrN3O4/c1-15(2)16(3)8-9-17(15,13(16)18)14(23)20-19-12(22)10-4-6-11(7-5-10)21(24)25/h4-7,13H,8-9H2,1-3H3,(H,19,22)(H,20,23)