3-(2-fluoranyl-4-methoxy-phenyl)-N-(4-morpholin-4-ylphenyl)adamantane-1-carboxamide

Systemtic Name: 3-(2-fluoranyl-4-methoxy-phenyl)-N-(4-morpholin-4-ylphenyl)adamantane-1-carboxamide Openeye Name: 3-(2-fluoro-4-methoxy-phenyl)-N-(4-morpholinophenyl)adamantane-1-carboxamide CAS Name: 3-(2-fluoro-4-methoxyphenyl)-N-[4-(4-morpholinyl)phenyl]-1-adamantanecarboxamide IUPAC Name: 3-(2-fluoro-4-methoxyphenyl)-N-(4-morpholin-4-ylphenyl)adamantane-1-carboxamide Traditional Name: 3-(2-fluoro-4-methoxy-phenyl)-N-(4-morpholinophenyl)adamantane-1-carboxamide Formula: C28H33FN2O3 MolecularWeight: 464.571623

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NC5=CC=C(C=C5)N6CCOCC6)F

Isomeric SMILES

COC1=CC(=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NC5=CC=C(C=C5)N6CCOCC6)F

InChI

InChI=1S/C28H33FN2O3/c1-33-23-6-7-24(25(29)13-23)27-14-19-12-20(15-27)17-28(16-19,18-27)26(32)30-21-2-4-22(5-3-21)31-8-10-34-11-9-31/h2-7,13,19-20H,8-12,14-18H2,1H3,(H,30,32)