1-(diphenylmethyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium

Systemtic Name: 1-(diphenylmethyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium Openeye Name: 1-benzhydryl-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium CAS Name: 1-(diphenylmethyl)-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium IUPAC Name: 1-benzhydryl-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium Traditional Name: 1-benzhydryl-4-[2-(3,4,5-trimethoxyphenyl)ethyl]piperazin-4-ium Formula: C28H35N2O3+ MolecularWeight: 447.5891

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CC[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CC[NH+]2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

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