6-bromanyl-1,5,5-trimethyl-N-(4-phenyldiazenylphenyl)bicyclo[2.1.1]hexane-4-carboxamide

Systemtic Name: 6-bromanyl-1,5,5-trimethyl-N-(4-phenyldiazenylphenyl)bicyclo[2.1.1]hexane-4-carboxamide Openeye Name: 6-bromo-1,5,5-trimethyl-N-(4-phenylazophenyl)bicyclo[2.1.1]hexane-4-carboxamide CAS Name: 6-bromo-1,5,5-trimethyl-N-(4-phenyldiazenylphenyl)-4-bicyclo[2.1.1]hexanecarboxamide IUPAC Name: 6-bromo-1,5,5-trimethyl-N-(4-phenyldiazenylphenyl)bicyclo[2.1.1]hexane-4-carboxamide Traditional Name: 6-bromo-1,5,5-trimethyl-N-(4-phenylazophenyl)bicyclo[2.1.1]hexane-4-carboxamide Formula: C22H24BrN3O MolecularWeight: 426.34946

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(C2Br)C(=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4)C)C

Isomeric SMILES

CC1(C2(CCC1(C2Br)C(=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4)C)C

InChI

InChI=1S/C22H24BrN3O/c1-20(2)21(3)13-14-22(20,18(21)23)19(27)24-15-9-11-17(12-10-15)26-25-16-7-5-4-6-8-16/h4-12,18H,13-14H2,1-3H3,(H,24,27)