1,3-benzodioxol-5-yl-(4-cyclohexylpiperazin-4-ium-1-yl)methanone

Systemtic Name: 1,3-benzodioxol-5-yl-(4-cyclohexylpiperazin-4-ium-1-yl)methanone Openeye Name: 1,3-benzodioxol-5-yl-(4-cyclohexylpiperazin-4-ium-1-yl)methanone CAS Name: 1,3-benzodioxol-5-yl-(4-cyclohexyl-1-piperazin-4-iumyl)methanone IUPAC Name: 1,3-benzodioxol-5-yl-(4-cyclohexylpiperazin-4-ium-1-yl)methanone Traditional Name: 1,3-benzodioxol-5-yl-(4-cyclohexylpiperazin-4-ium-1-yl)methanone Formula: C18H25N2O3+ MolecularWeight: 317.4027

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(CC1)[NH+]2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H24N2O3/c21-18(14-6-7-16-17(12-14)23-13-22-16)20-10-8-19(9-11-20)15-4-2-1-3-5-15/h6-7,12,15H,1-5,8-11,13H2/p+1