4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzonitrile CAS Name: 4-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]benzonitrile IUPAC Name: 4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]benzonitrile Formula: C19H22N3O+ MolecularWeight: 308.39748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H21N3O/c1-23-19-5-3-2-4-18(19)22-12-10-21(11-13-22)15-17-8-6-16(14-20)7-9-17/h2-9H,10-13,15H2,1H3/p+1