4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-1-ethyl-4-phenyl-azepane

Systemtic Name: 4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-1-ethyl-4-phenyl-azepane Openeye Name: 4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-1-ethyl-4-phenyl-azepane CAS Name: 4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-1-ethyl-4-phenylazepane IUPAC Name: 4-[[3,5-bis(trifluoromethyl)phenyl]methoxymethyl]-1-ethyl-4-phenylazepane Traditional Name: 4-[[3,5-bis(trifluoromethyl)benzyl]oxymethyl]-1-ethyl-4-phenyl-azepane Formula: C24H27F6NO MolecularWeight: 459.467699

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC(CC1)(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CCN1CCCC(CC1)(COCC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C24H27F6NO/c1-2-31-11-6-9-22(10-12-31,19-7-4-3-5-8-19)17-32-16-18-13-20(23(25,26)27)15-21(14-18)24(28,29)30/h3-5,7-8,13-15H,2,6,9-12,16-17H2,1H3