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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=CC(=C1)CN2CC[NH2+]CC2)OC

Isomeric SMILES

CC(C)COC1=C(C=CC(=C1)CN2CC[NH2+]CC2)OC

InChI

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