N-(5-bromanyl-2-morpholin-4-yl-phenyl)-3-chloranyl-adamantane-1-carboxamide

Systemtic Name: N-(5-bromanyl-2-morpholin-4-yl-phenyl)-3-chloranyl-adamantane-1-carboxamide Openeye Name: N-(5-bromo-2-morpholino-phenyl)-3-chloro-adamantane-1-carboxamide CAS Name: N-[5-bromo-2-(4-morpholinyl)phenyl]-3-chloro-1-adamantanecarboxamide IUPAC Name: N-(5-bromo-2-morpholin-4-ylphenyl)-3-chloroadamantane-1-carboxamide Traditional Name: N-(5-bromo-2-morpholino-phenyl)-3-chloro-adamantane-1-carboxamide Formula: C21H26BrClN2O2 MolecularWeight: 453.80034

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)Br)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)Br)NC(=O)C34CC5CC(C3)CC(C5)(C4)Cl

InChI

InChI=1S/C21H26BrClN2O2/c22-16-1-2-18(25-3-5-27-6-4-25)17(8-16)24-19(26)20-9-14-7-15(10-20)12-21(23,11-14)13-20/h1-2,8,14-15H,3-7,9-13H2,(H,24,26)