1-(2-methylphenyl)-4-[(4-phenylphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(2-methylphenyl)-4-[(4-phenylphenyl)methyl]piperazin-4-ium Openeye Name: 1-(o-tolyl)-4-[(4-phenylphenyl)methyl]piperazin-4-ium CAS Name: 1-(2-methylphenyl)-4-[(4-phenylphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-methylphenyl)-4-[(4-phenylphenyl)methyl]piperazin-4-ium Traditional Name: 1-(o-tolyl)-4-(4-phenylbenzyl)piperazin-4-ium Formula: C24H27N2+ MolecularWeight: 343.48458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N2/c1-20-7-5-6-10-24(20)26-17-15-25(16-18-26)19-21-11-13-23(14-12-21)22-8-3-2-4-9-22/h2-14H,15-19H2,1H3/p+1