1-(1,3-benzodioxol-5-ylmethyl)-4-(2,2-diphenylethyl)piperazine-1,4-diium

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,2-diphenylethyl)piperazine-1,4-diium Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,2-diphenylethyl)piperazine-1,4-diium CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,2-diphenylethyl)piperazine-1,4-diium IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(2,2-diphenylethyl)piperazine-1,4-diium Traditional Name: 1-(2,2-diphenylethyl)-4-piperonyl-piperazine-1,4-diium Formula: C26H30N2O2+2 MolecularWeight: 402.5286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC2=CC3=C(C=C2)OCO3)CC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CC[NH+]1CC2=CC3=C(C=C2)OCO3)CC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H28N2O2/c1-3-7-22(8-4-1)24(23-9-5-2-6-10-23)19-28-15-13-27(14-16-28)18-21-11-12-25-26(17-21)30-20-29-25/h1-12,17,24H,13-16,18-20H2/p+2