4-[3-(2,5-dimethylphenoxy)propyl]piperazin-4-ium-2-one

Systemtic Name: 4-[3-(2,5-dimethylphenoxy)propyl]piperazin-4-ium-2-one Openeye Name: 4-[3-(2,5-dimethylphenoxy)propyl]piperazin-4-ium-2-one CAS Name: 4-[3-(2,5-dimethylphenoxy)propyl]-2-piperazin-4-iumone IUPAC Name: 4-[3-(2,5-dimethylphenoxy)propyl]piperazin-4-ium-2-one Traditional Name: 4-[3-(2,5-dimethylphenoxy)propyl]piperazin-4-ium-2-one Formula: C15H23N2O2+ MolecularWeight: 263.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OCCC[NH+]2CCNC(=O)C2

Isomeric SMILES

CC1=CC(=C(C=C1)C)OCCC[NH+]2CCNC(=O)C2

InChI

InChI=1S/C15H22N2O2/c1-12-4-5-13(2)14(10-12)19-9-3-7-17-8-6-16-15(18)11-17/h4-5,10H,3,6-9,11H2,1-2H3,(H,16,18)/p+1