1-[(2,5-dimethylphenyl)methyl]-4-(phenylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[(2,5-dimethylphenyl)methyl]-4-(phenylmethyl)piperazine-1,4-diium Openeye Name: 1-benzyl-4-[(2,5-dimethylphenyl)methyl]piperazine-1,4-diium CAS Name: 1-[(2,5-dimethylphenyl)methyl]-4-(phenylmethyl)piperazine-1,4-diium IUPAC Name: 1-benzyl-4-[(2,5-dimethylphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-benzyl-4-(2,5-dimethylbenzyl)piperazine-1,4-diium Formula: C20H28N2+2 MolecularWeight: 296.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H26N2/c1-17-8-9-18(2)20(14-17)16-22-12-10-21(11-13-22)15-19-6-4-3-5-7-19/h3-9,14H,10-13,15-16H2,1-2H3/p+2