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1-(2,5-dimethylphenyl)-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium

1-(2,5-dimethylphenyl)-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium

Systemtic Name:1-(2,5-dimethylphenyl)-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium
Openeye Name:1-(2,5-dimethylphenyl)-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium
CAS Name:1-(2,5-dimethylphenyl)-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium
IUPAC Name:1-(2,5-dimethylphenyl)-4-[(2,4-dimethylphenyl)methyl]piperazin-4-ium
Traditional Name:1-(2,4-dimethylbenzyl)-4-(2,5-dimethylphenyl)piperazin-1-ium
Formula: C21H29N2+
MolecularWeight: 309.46836
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C[NH+]2CCN(CC2)C3=C(C=CC(=C3)C)C)C


Isomeric SMILES

CC1=CC(=C(C=C1)C[NH+]2CCN(CC2)C3=C(C=CC(=C3)C)C)C


InChI

InChI=1S/C21H28N2/c1-16-6-8-20(19(4)13-16)15-22-9-11-23(12-10-22)21-14-17(2)5-7-18(21)3/h5-8,13-14H,9-12,15H2,1-4H3/p+1


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