1-[[1-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-cyclopentyl-piperazin-4-ium

Systemtic Name: 1-[[1-(1,3-benzodioxol-5-ylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]-4-cyclopentyl-piperazin-4-ium Openeye Name: 1-[[1-(1,3-benzodioxol-5-ylmethyl)tetrazol-5-yl]methyl]-4-cyclopentyl-piperazin-4-ium CAS Name: 1-[[1-(1,3-benzodioxol-5-ylmethyl)-5-tetrazolyl]methyl]-4-cyclopentylpiperazin-4-ium IUPAC Name: 1-[[1-(1,3-benzodioxol-5-ylmethyl)tetrazol-5-yl]methyl]-4-cyclopentylpiperazin-4-ium Traditional Name: 1-cyclopentyl-4-[(1-piperonyltetrazol-5-yl)methyl]piperazin-1-ium Formula: C19H27N6O2+ MolecularWeight: 371.45668

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCN(CC2)CC3=NN=NN3CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(C1)[NH+]2CCN(CC2)CC3=NN=NN3CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C19H26N6O2/c1-2-4-16(3-1)24-9-7-23(8-10-24)13-19-20-21-22-25(19)12-15-5-6-17-18(11-15)27-14-26-17/h5-6,11,16H,1-4,7-10,12-14H2/p+1