1-[3-(2,6-dimethylphenoxy)propyl]piperazine-1,4-diium

Systemtic Name: 1-[3-(2,6-dimethylphenoxy)propyl]piperazine-1,4-diium Openeye Name: 1-[3-(2,6-dimethylphenoxy)propyl]piperazine-1,4-diium CAS Name: 1-[3-(2,6-dimethylphenoxy)propyl]piperazine-1,4-diium IUPAC Name: 1-[3-(2,6-dimethylphenoxy)propyl]piperazine-1,4-diium Traditional Name: 1-[3-(2,6-dimethylphenoxy)propyl]piperazine-1,4-diium Formula: C15H26N2O+2 MolecularWeight: 250.37974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCC[NH+]2CC[NH2+]CC2

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCC[NH+]2CC[NH2+]CC2

InChI

InChI=1S/C15H24N2O/c1-13-5-3-6-14(2)15(13)18-12-4-9-17-10-7-16-8-11-17/h3,5-6,16H,4,7-12H2,1-2H3/p+2