1-[(1S)-1-(4-bromophenyl)ethyl]piperidin-1-ium-4-one

Systemtic Name: 1-[(1S)-1-(4-bromophenyl)ethyl]piperidin-1-ium-4-one Openeye Name: 1-[(1S)-1-(4-bromophenyl)ethyl]piperidin-1-ium-4-one CAS Name: 1-[(1S)-1-(4-bromophenyl)ethyl]-4-piperidin-1-iumone IUPAC Name: 1-[(1S)-1-(4-bromophenyl)ethyl]piperidin-1-ium-4-one Traditional Name: 1-[(1S)-1-(4-bromophenyl)ethyl]piperidin-1-ium-4-one Formula: C13H17BrNO+ MolecularWeight: 283.18418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)Br)[NH+]2CCC(=O)CC2

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)Br)[NH+]2CCC(=O)CC2

InChI

InChI=1S/C13H16BrNO/c1-10(11-2-4-12(14)5-3-11)15-8-6-13(16)7-9-15/h2-5,10H,6-9H2,1H3/p+1/t10-/m0/s1