1-(2,2-diphenylethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium

Systemtic Name: 1-(2,2-diphenylethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1-(2,2-diphenylethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium CAS Name: 1-(2,2-diphenylethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1-(2,2-diphenylethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-(2,2-diphenylethyl)-4-(2,3,4-trimethoxybenzyl)piperazin-1-ium Formula: C28H35N2O3+ MolecularWeight: 447.5891

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CC[NH+](CC2)CC(C3=CC=CC=C3)C4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CC[NH+](CC2)CC(C3=CC=CC=C3)C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C28H34N2O3/c1-31-26-15-14-24(27(32-2)28(26)33-3)20-29-16-18-30(19-17-29)21-25(22-10-6-4-7-11-22)23-12-8-5-9-13-23/h4-15,25H,16-21H2,1-3H3/p+1