1-(2-ethoxyphenyl)-4-[(5-methyl-1H-imidazol-4-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(2-ethoxyphenyl)-4-[(5-methyl-1H-imidazol-4-yl)methyl]piperazin-4-ium Openeye Name: 1-(2-ethoxyphenyl)-4-[(5-methyl-1H-imidazol-4-yl)methyl]piperazin-4-ium CAS Name: 1-(2-ethoxyphenyl)-4-[(5-methyl-1H-imidazol-4-yl)methyl]piperazin-4-ium IUPAC Name: 1-(2-ethoxyphenyl)-4-[(5-methyl-1H-imidazol-4-yl)methyl]piperazin-4-ium Traditional Name: 1-[(5-methyl-1H-imidazol-4-yl)methyl]-4-o-phenetyl-piperazin-1-ium Formula: C17H25N4O+ MolecularWeight: 301.4066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=C(NC=N3)C

Isomeric SMILES

CCOC1=CC=CC=C1N2CC[NH+](CC2)CC3=C(NC=N3)C

InChI

InChI=1S/C17H24N4O/c1-3-22-17-7-5-4-6-16(17)21-10-8-20(9-11-21)12-15-14(2)18-13-19-15/h4-7,13H,3,8-12H2,1-2H3,(H,18,19)/p+1