(5-chloranyl-2-methoxy-phenyl)-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (5-chloro-2-methoxy-phenyl)-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]methanone CAS Name: (5-chloro-2-methoxyphenyl)-[4-[[(2R)-2-oxolanyl]methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (5-chloro-2-methoxyphenyl)-[4-[[(2R)-oxolan-2-yl]methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (5-chloro-2-methoxy-phenyl)-[4-[[(2R)-tetrahydrofuran-2-yl]methyl]piperazin-4-ium-1-yl]methanone Formula: C17H24ClN2O3+ MolecularWeight: 339.83706

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)N2CC[NH+](CC2)CC3CCCO3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)N2CC[NH+](CC2)C[C@H]3CCCO3

InChI

InChI=1S/C17H23ClN2O3/c1-22-16-5-4-13(18)11-15(16)17(21)20-8-6-19(7-9-20)12-14-3-2-10-23-14/h4-5,11,14H,2-3,6-10,12H2,1H3/p+1/t14-/m1/s1