1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]piperazine-1,4-diium

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]piperazine-1,4-diium Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]piperazine-1,4-diium CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]piperazine-1,4-diium IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]piperazine-1,4-diium Traditional Name: 1-[4-(1,3-benzodioxol-5-yloxy)but-2-ynyl]-4-piperonyl-piperazine-1,4-diium Formula: C23H26N2O5+2 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CC#CCOC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C[NH+](CC[NH+]1CC#CCOC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H24N2O5/c1(2-12-26-19-4-6-21-23(14-19)30-17-28-21)7-24-8-10-25(11-9-24)15-18-3-5-20-22(13-18)29-16-27-20/h3-6,13-14H,7-12,15-17H2/p+2