1-cycloheptyl-4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-cycloheptyl-4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium Openeye Name: 1-cycloheptyl-4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium CAS Name: 1-cycloheptyl-4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-cycloheptyl-4-[(3-methoxyphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-cycloheptyl-4-m-anisyl-piperazine-1,4-diium Formula: C19H32N2O+2 MolecularWeight: 304.47018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C[NH+]2CC[NH+](CC2)C3CCCCCC3

Isomeric SMILES

COC1=CC=CC(=C1)C[NH+]2CC[NH+](CC2)C3CCCCCC3

InChI

InChI=1S/C19H30N2O/c1-22-19-10-6-7-17(15-19)16-20-11-13-21(14-12-20)18-8-4-2-3-5-9-18/h6-7,10,15,18H,2-5,8-9,11-14,16H2,1H3/p+2