1-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-cyclopentyl-piperazin-4-ium

Systemtic Name: 1-[(5-bromanyl-2-methoxy-phenyl)methyl]-4-cyclopentyl-piperazin-4-ium Openeye Name: 1-[(5-bromo-2-methoxy-phenyl)methyl]-4-cyclopentyl-piperazin-4-ium CAS Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-cyclopentylpiperazin-4-ium IUPAC Name: 1-[(5-bromo-2-methoxyphenyl)methyl]-4-cyclopentylpiperazin-4-ium Traditional Name: 1-(5-bromo-2-methoxy-benzyl)-4-cyclopentyl-piperazin-4-ium Formula: C17H26BrN2O+ MolecularWeight: 354.30514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CN2CC[NH+](CC2)C3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CN2CC[NH+](CC2)C3CCCC3

InChI

InChI=1S/C17H25BrN2O/c1-21-17-7-6-15(18)12-14(17)13-19-8-10-20(11-9-19)16-4-2-3-5-16/h6-7,12,16H,2-5,8-11,13H2,1H3/p+1