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

Systemtic Name: 1-(2-methylphenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-4-(o-tolyl)piperazin-1-ium CAS Name: 1-(2-methylphenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-methylphenyl)-4-[(4-phenylmethoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-(4-benzoxybenzyl)-4-(o-tolyl)piperazin-1-ium Formula: C25H29N2O+ MolecularWeight: 373.51056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C25H28N2O/c1-21-7-5-6-10-25(21)27-17-15-26(16-18-27)19-22-11-13-24(14-12-22)28-20-23-8-3-2-4-9-23/h2-14H,15-20H2,1H3/p+1