N-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]cycloheptanamine

Systemtic Name: N-[(3-bromanyl-4,5-dimethoxy-phenyl)methyl]cycloheptanamine Openeye Name: N-[(3-bromo-4,5-dimethoxy-phenyl)methyl]cycloheptanamine CAS Name: N-[(3-bromo-4,5-dimethoxyphenyl)methyl]cycloheptanamine IUPAC Name: N-[(3-bromo-4,5-dimethoxyphenyl)methyl]cycloheptanamine Traditional Name: (3-bromo-4,5-dimethoxy-benzyl)-cycloheptyl-amine Formula: C16H24BrNO2 MolecularWeight: 342.27126

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNC2CCCCCC2)Br)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CNC2CCCCCC2)Br)OC

InChI

InChI=1S/C16H24BrNO2/c1-19-15-10-12(9-14(17)16(15)20-2)11-18-13-7-5-3-4-6-8-13/h9-10,13,18H,3-8,11H2,1-2H3