N-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]cycloheptanamine

Systemtic Name: N-[[3-bromanyl-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]cycloheptanamine Openeye Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]cycloheptanamine CAS Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]cycloheptanamine IUPAC Name: N-[[3-bromo-4-[(4-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]cycloheptanamine Traditional Name: [3-bromo-4-(4-fluorobenzyl)oxy-5-methoxy-benzyl]-cycloheptyl-amine Formula: C22H27BrFNO2 MolecularWeight: 436.357683

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2CCCCCC2)Br)OCC3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2CCCCCC2)Br)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H27BrFNO2/c1-26-21-13-17(14-25-19-6-4-2-3-5-7-19)12-20(23)22(21)27-15-16-8-10-18(24)11-9-16/h8-13,19,25H,2-7,14-15H2,1H3