1-[(2,5-dimethylphenyl)methyl]-4-ethyl-piperazine-1,4-diium

Systemtic Name: 1-[(2,5-dimethylphenyl)methyl]-4-ethyl-piperazine-1,4-diium Openeye Name: 1-[(2,5-dimethylphenyl)methyl]-4-ethyl-piperazine-1,4-diium CAS Name: 1-[(2,5-dimethylphenyl)methyl]-4-ethylpiperazine-1,4-diium IUPAC Name: 1-[(2,5-dimethylphenyl)methyl]-4-ethylpiperazine-1,4-diium Traditional Name: 1-(2,5-dimethylbenzyl)-4-ethyl-piperazine-1,4-diium Formula: C15H26N2+2 MolecularWeight: 234.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC(=C2)C)C

Isomeric SMILES

CC[NH+]1CC[NH+](CC1)CC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C15H24N2/c1-4-16-7-9-17(10-8-16)12-15-11-13(2)5-6-14(15)3/h5-6,11H,4,7-10,12H2,1-3H3/p+2