1-(4-bromanylphenoxy)-4-piperidin-1-ium-1-yl-butan-2-one

Systemtic Name: 1-(4-bromanylphenoxy)-4-piperidin-1-ium-1-yl-butan-2-one Openeye Name: 1-(4-bromophenoxy)-4-piperidin-1-ium-1-yl-butan-2-one CAS Name: 1-(4-bromophenoxy)-4-(1-piperidin-1-iumyl)-2-butanone IUPAC Name: 1-(4-bromophenoxy)-4-piperidin-1-ium-1-ylbutan-2-one Traditional Name: 1-(4-bromophenoxy)-4-piperidin-1-ium-1-yl-butan-2-one Formula: C15H21BrNO2+ MolecularWeight: 327.23674

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC(=O)COC2=CC=C(C=C2)Br

Isomeric SMILES

C1CC[NH+](CC1)CCC(=O)COC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H20BrNO2/c16-13-4-6-15(7-5-13)19-12-14(18)8-11-17-9-2-1-3-10-17/h4-7H,1-3,8-12H2/p+1