1-(1,3-benzodioxol-5-ylmethyl)-4-cycloheptyl-piperazin-4-ium

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-cycloheptyl-piperazin-4-ium Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-cycloheptyl-piperazin-4-ium CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-cycloheptylpiperazin-4-ium IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-cycloheptylpiperazin-4-ium Traditional Name: 1-cycloheptyl-4-piperonyl-piperazin-1-ium Formula: C19H29N2O2+ MolecularWeight: 317.44576

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)[NH+]2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCCC(CC1)[NH+]2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H28N2O2/c1-2-4-6-17(5-3-1)21-11-9-20(10-12-21)14-16-7-8-18-19(13-16)23-15-22-18/h7-8,13,17H,1-6,9-12,14-15H2/p+1