N-[4-[[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenoxy]methyl]phenyl]-N-methyl-azepane-1-carboxamide

Systemtic Name: N-[4-[[3-fluoranyl-5-(4-methoxyoxan-4-yl)phenoxy]methyl]phenyl]-N-methyl-azepane-1-carboxamide Openeye Name: N-[4-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenoxy]methyl]phenyl]-N-methyl-azepane-1-carboxamide CAS Name: N-[4-[[3-fluoro-5-(4-methoxy-4-oxanyl)phenoxy]methyl]phenyl]-N-methyl-1-azepanecarboxamide IUPAC Name: N-[4-[[3-fluoro-5-(4-methoxyoxan-4-yl)phenoxy]methyl]phenyl]-N-methylazepane-1-carboxamide Traditional Name: N-[4-[[3-fluoro-5-(4-methoxytetrahydropyran-4-yl)phenoxy]methyl]phenyl]-N-methyl-azepane-1-carboxamide Formula: C27H35FN2O4 MolecularWeight: 470.576203

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)COC2=CC(=CC(=C2)C3(CCOCC3)OC)F)C(=O)N4CCCCCC4

Isomeric SMILES

CN(C1=CC=C(C=C1)COC2=CC(=CC(=C2)C3(CCOCC3)OC)F)C(=O)N4CCCCCC4

InChI

InChI=1S/C27H35FN2O4/c1-29(26(31)30-13-5-3-4-6-14-30)24-9-7-21(8-10-24)20-34-25-18-22(17-23(28)19-25)27(32-2)11-15-33-16-12-27/h7-10,17-19H,3-6,11-16,20H2,1-2H3