1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium-1-yl]-3-propan-2-yloxy-propan-2-ol

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium-1-yl]-3-propan-2-yloxy-propan-2-ol Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium-1-yl]-3-isopropoxy-propan-2-ol CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazine-1,4-diiumyl]-3-propan-2-yloxy-2-propanol IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1,4-diium-1-yl]-3-propan-2-yloxypropan-2-ol Traditional Name: 1-isopropoxy-3-(4-piperonylpiperazine-1,4-diium-1-yl)propan-2-ol Formula: C18H30N2O4+2 MolecularWeight: 338.4418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCC(C[NH+]1CC[NH+](CC1)CC2=CC3=C(C=C2)OCO3)O

Isomeric SMILES

CC(C)OCC(C[NH+]1CC[NH+](CC1)CC2=CC3=C(C=C2)OCO3)O

InChI

InChI=1S/C18H28N2O4/c1-14(2)22-12-16(21)11-20-7-5-19(6-8-20)10-15-3-4-17-18(9-15)24-13-23-17/h3-4,9,14,16,21H,5-8,10-13H2,1-2H3/p+2