1-(2,4-dimethylphenyl)piperazin-4-ium-2-one

Systemtic Name: 1-(2,4-dimethylphenyl)piperazin-4-ium-2-one Openeye Name: 1-(2,4-dimethylphenyl)piperazin-4-ium-2-one CAS Name: 1-(2,4-dimethylphenyl)-2-piperazin-4-iumone IUPAC Name: 1-(2,4-dimethylphenyl)piperazin-4-ium-2-one Traditional Name: 1-(2,4-dimethylphenyl)piperazin-4-ium-2-one Formula: C12H17N2O+ MolecularWeight: 205.27618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CC[NH2+]CC2=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CC[NH2+]CC2=O)C

InChI

InChI=1S/C12H16N2O/c1-9-3-4-11(10(2)7-9)14-6-5-13-8-12(14)15/h3-4,7,13H,5-6,8H2,1-2H3/p+1