N-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl]cyclopentanamine

Systemtic Name: N-[(3-bromanyl-5-ethoxy-4-phenylmethoxy-phenyl)methyl]cyclopentanamine Openeye Name: N-[(4-benzyloxy-3-bromo-5-ethoxy-phenyl)methyl]cyclopentanamine CAS Name: N-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methyl]cyclopentanamine IUPAC Name: N-[(3-bromo-5-ethoxy-4-phenylmethoxyphenyl)methyl]cyclopentanamine Traditional Name: (4-benzoxy-3-bromo-5-ethoxy-benzyl)-cyclopentyl-amine Formula: C21H26BrNO2 MolecularWeight: 404.34064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2CCCC2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2CCCC2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C21H26BrNO2/c1-2-24-20-13-17(14-23-18-10-6-7-11-18)12-19(22)21(20)25-15-16-8-4-3-5-9-16/h3-5,8-9,12-13,18,23H,2,6-7,10-11,14-15H2,1H3