1-[(2,5-dimethylphenyl)methyl]-4-methyl-piperazin-4-ium

Systemtic Name: 1-[(2,5-dimethylphenyl)methyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[(2,5-dimethylphenyl)methyl]-4-methyl-piperazin-4-ium CAS Name: 1-[(2,5-dimethylphenyl)methyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[(2,5-dimethylphenyl)methyl]-4-methylpiperazin-4-ium Traditional Name: 1-(2,5-dimethylbenzyl)-4-methyl-piperazin-4-ium Formula: C14H23N2+ MolecularWeight: 219.34582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CN2CC[NH+](CC2)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)CN2CC[NH+](CC2)C

InChI

InChI=1S/C14H22N2/c1-12-4-5-13(2)14(10-12)11-16-8-6-15(3)7-9-16/h4-5,10H,6-9,11H2,1-3H3/p+1