1-[4-(2,6-dimethylphenoxy)butyl]piperazin-4-ium

Systemtic Name: 1-[4-(2,6-dimethylphenoxy)butyl]piperazin-4-ium Openeye Name: 1-[4-(2,6-dimethylphenoxy)butyl]piperazin-4-ium CAS Name: 1-[4-(2,6-dimethylphenoxy)butyl]piperazin-4-ium IUPAC Name: 1-[4-(2,6-dimethylphenoxy)butyl]piperazin-4-ium Traditional Name: 1-[4-(2,6-dimethylphenoxy)butyl]piperazin-4-ium Formula: C16H27N2O+ MolecularWeight: 263.39838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCCCN2CC[NH2+]CC2

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCCCN2CC[NH2+]CC2

InChI

InChI=1S/C16H26N2O/c1-14-6-5-7-15(2)16(14)19-13-4-3-10-18-11-8-17-9-12-18/h5-7,17H,3-4,8-13H2,1-2H3/p+1