N-[[3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]cycloheptanamine

Systemtic Name: N-[[3-bromanyl-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]cycloheptanamine Openeye Name: N-[[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxy-phenyl]methyl]cycloheptanamine CAS Name: N-[[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]cycloheptanamine IUPAC Name: N-[[3-bromo-4-[(2-fluorophenyl)methoxy]-5-methoxyphenyl]methyl]cycloheptanamine Traditional Name: [3-bromo-4-(2-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=CC=C3F

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2CCCCCC2)Br)OCC3=CC=CC=C3F

InChI

InChI=1S/C22H27BrFNO2/c1-26-21-13-16(14-25-18-9-4-2-3-5-10-18)12-19(23)22(21)27-15-17-8-6-7-11-20(17)24/h6-8,11-13,18,25H,2-5,9-10,14-15H2,1H3