2-[4-[(3,4-dimethylphenyl)methyl]piperazin-4-ium-1-yl]ethylazanium

Systemtic Name: 2-[4-[(3,4-dimethylphenyl)methyl]piperazin-4-ium-1-yl]ethylazanium Openeye Name: 2-[4-[(3,4-dimethylphenyl)methyl]piperazin-4-ium-1-yl]ethylammonium CAS Name: 2-[4-[(3,4-dimethylphenyl)methyl]-1-piperazin-4-iumyl]ethylammonium IUPAC Name: 2-[4-[(3,4-dimethylphenyl)methyl]piperazin-4-ium-1-yl]ethylazanium Traditional Name: 2-[4-(3,4-dimethylbenzyl)piperazin-4-ium-1-yl]ethylammonium Formula: C15H27N3+2 MolecularWeight: 249.39498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH+]2CCN(CC2)CC[NH3+])C

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH+]2CCN(CC2)CC[NH3+])C

InChI

InChI=1S/C15H25N3/c1-13-3-4-15(11-14(13)2)12-18-9-7-17(6-5-16)8-10-18/h3-4,11H,5-10,12,16H2,1-2H3/p+2