2-(2-chloranylphenoxy)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 2-(2-chloranylphenoxy)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 2-(2-chlorophenoxy)-1-[4-(2-furylmethyl)piperazin-4-ium-1-yl]ethanone CAS Name: 2-(2-chlorophenoxy)-1-[4-(2-furanylmethyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 2-(2-chlorophenoxy)-1-[4-(furan-2-ylmethyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 2-(2-chlorophenoxy)-1-[4-(2-furfuryl)piperazin-4-ium-1-yl]ethanone Formula: C17H20ClN2O3+ MolecularWeight: 335.8053

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)COC3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CO2)C(=O)COC3=CC=CC=C3Cl

InChI

InChI=1S/C17H19ClN2O3/c18-15-5-1-2-6-16(15)23-13-17(21)20-9-7-19(8-10-20)12-14-4-3-11-22-14/h1-6,11H,7-10,12-13H2/p+1