1-(4-bromophenyl)-3-(3-methylpiperidin-1-ium-1-yl)propan-1-one

Systemtic Name: 1-(4-bromophenyl)-3-(3-methylpiperidin-1-ium-1-yl)propan-1-one Openeye Name: 1-(4-bromophenyl)-3-(3-methylpiperidin-1-ium-1-yl)propan-1-one CAS Name: 1-(4-bromophenyl)-3-(3-methyl-1-piperidin-1-iumyl)-1-propanone IUPAC Name: 1-(4-bromophenyl)-3-(3-methylpiperidin-1-ium-1-yl)propan-1-one Traditional Name: 1-(4-bromophenyl)-3-(3-methylpiperidin-1-ium-1-yl)propan-1-one Formula: C15H21BrNO+ MolecularWeight: 311.23734

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CCC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CC1CCC[NH+](C1)CCC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H20BrNO/c1-12-3-2-9-17(11-12)10-8-15(18)13-4-6-14(16)7-5-13/h4-7,12H,2-3,8-11H2,1H3/p+1