3-bromanyl-N-(4-phenyldiazenylphenyl)adamantane-1-carboxamide

Systemtic Name: 3-bromanyl-N-(4-phenyldiazenylphenyl)adamantane-1-carboxamide Openeye Name: 3-bromo-N-(4-phenylazophenyl)adamantane-1-carboxamide CAS Name: 3-bromo-N-(4-phenyldiazenylphenyl)-1-adamantanecarboxamide IUPAC Name: 3-bromo-N-(4-phenyldiazenylphenyl)adamantane-1-carboxamide Traditional Name: 3-bromo-N-(4-phenylazophenyl)adamantane-1-carboxamide Formula: C23H24BrN3O MolecularWeight: 438.36016

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Br)C(=O)NC4=CC=C(C=C4)N=NC5=CC=CC=C5

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Br)C(=O)NC4=CC=C(C=C4)N=NC5=CC=CC=C5

InChI

InChI=1S/C23H24BrN3O/c24-23-13-16-10-17(14-23)12-22(11-16,15-23)21(28)25-18-6-8-20(9-7-18)27-26-19-4-2-1-3-5-19/h1-9,16-17H,10-15H2,(H,25,28)