1-[(2R)-1-(3,4-dimethylphenoxy)propan-2-yl]piperazin-4-ium

Systemtic Name: 1-[(2R)-1-(3,4-dimethylphenoxy)propan-2-yl]piperazin-4-ium Openeye Name: 1-[(1R)-2-(3,4-dimethylphenoxy)-1-methyl-ethyl]piperazin-4-ium CAS Name: 1-[(2R)-1-(3,4-dimethylphenoxy)propan-2-yl]piperazin-4-ium IUPAC Name: 1-[(2R)-1-(3,4-dimethylphenoxy)propan-2-yl]piperazin-4-ium Traditional Name: 1-[(1R)-2-(3,4-dimethylphenoxy)-1-methyl-ethyl]piperazin-4-ium Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)OC[C@@H](C)N2CC[NH2+]CC2)C

InChI

InChI=1S/C15H24N2O/c1-12-4-5-15(10-13(12)2)18-11-14(3)17-8-6-16-7-9-17/h4-5,10,14,16H,6-9,11H2,1-3H3/p+1/t14-/m1/s1