1-[(4-bromophenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-[(4-bromophenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine-1,4-diium Openeye Name: 1-[(4-bromophenyl)methyl]-4-(m-tolylmethyl)piperazine-1,4-diium CAS Name: 1-[(4-bromophenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-[(4-bromophenyl)methyl]-4-[(3-methylphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-(4-bromobenzyl)-4-(3-methylbenzyl)piperazine-1,4-diium Formula: C19H25BrN2+2 MolecularWeight: 361.3192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23BrN2/c1-16-3-2-4-18(13-16)15-22-11-9-21(10-12-22)14-17-5-7-19(20)8-6-17/h2-8,13H,9-12,14-15H2,1H3/p+2