[4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-[(2S)-oxolan-2-yl]methanone

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-[(2S)-oxolan-2-yl]methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-[(2S)-tetrahydrofuran-2-yl]methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]-[(2S)-2-oxolanyl]methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-[(2S)-oxolan-2-yl]methanone Traditional Name: (4-piperonylpiperazin-4-ium-1-yl)-[(2S)-tetrahydrofuran-2-yl]methanone Formula: C17H23N2O4+ MolecularWeight: 319.37552

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C(=O)N2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[C@H](OC1)C(=O)N2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C17H22N2O4/c20-17(15-2-1-9-21-15)19-7-5-18(6-8-19)11-13-3-4-14-16(10-13)23-12-22-14/h3-4,10,15H,1-2,5-9,11-12H2/p+1/t15-/m0/s1