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

Systemtic Name: 1-[(2-methylphenyl)methyl]-4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1-(o-tolylmethyl)-4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-[(2-methylphenyl)methyl]-4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1-[(2-methylphenyl)methyl]-4-[(2,4,5-trimethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-(2-methylbenzyl)-4-(2,4,5-trimethoxybenzyl)piperazin-1-ium Formula: C22H31N2O3+ MolecularWeight: 371.49314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)CC3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)CC3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C22H30N2O3/c1-17-7-5-6-8-18(17)15-23-9-11-24(12-10-23)16-19-13-21(26-3)22(27-4)14-20(19)25-2/h5-8,13-14H,9-12,15-16H2,1-4H3/p+1