1-[[3-methoxy-2-(2-methylpropoxy)phenyl]methyl]piperazin-4-ium

Systemtic Name: 1-[[3-methoxy-2-(2-methylpropoxy)phenyl]methyl]piperazin-4-ium Openeye Name: 1-[(2-isobutoxy-3-methoxy-phenyl)methyl]piperazin-4-ium CAS Name: 1-[[3-methoxy-2-(2-methylpropoxy)phenyl]methyl]piperazin-4-ium IUPAC Name: 1-[[3-methoxy-2-(2-methylpropoxy)phenyl]methyl]piperazin-4-ium Traditional Name: 1-(2-isobutoxy-3-methoxy-benzyl)piperazin-4-ium Formula: C16H27N2O2+ MolecularWeight: 279.39778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC=C1OC)CN2CC[NH2+]CC2

Isomeric SMILES

CC(C)COC1=C(C=CC=C1OC)CN2CC[NH2+]CC2

InChI

InChI=1S/C16H26N2O2/c1-13(2)12-20-16-14(5-4-6-15(16)19-3)11-18-9-7-17-8-10-18/h4-6,13,17H,7-12H2,1-3H3/p+1