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

Systemtic Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-(2,5-dimethylfuran-3-yl)methanone Openeye Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-(2,5-dimethyl-3-furyl)methanone CAS Name: [4-(1,3-benzodioxol-5-ylmethyl)-1-piperazin-4-iumyl]-(2,5-dimethyl-3-furanyl)methanone IUPAC Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-4-ium-1-yl]-(2,5-dimethylfuran-3-yl)methanone Traditional Name: (2,5-dimethyl-3-furyl)-(4-piperonylpiperazin-4-ium-1-yl)methanone Formula: C19H23N2O4+ MolecularWeight: 343.39692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)N2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)N2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H22N2O4/c1-13-9-16(14(2)25-13)19(22)21-7-5-20(6-8-21)11-15-3-4-17-18(10-15)24-12-23-17/h3-4,9-10H,5-8,11-12H2,1-2H3/p+1