(2,5-dimethylphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: (2,5-dimethylphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: (2,5-dimethylphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: (2,5-dimethylphenyl)-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: (2,5-dimethylphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: (2,5-dimethylphenyl)-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O/c1-11-4-5-12(2)13(10-11)14(17)16-8-6-15(3)7-9-16/h4-5,10H,6-9H2,1-3H3/p+1