[(3S)-1-[(2-bromophenyl)methyl]piperidin-1-ium-3-yl]methanol

Systemtic Name: [(3S)-1-[(2-bromophenyl)methyl]piperidin-1-ium-3-yl]methanol Openeye Name: [(3S)-1-[(2-bromophenyl)methyl]piperidin-1-ium-3-yl]methanol CAS Name: [(3S)-1-[(2-bromophenyl)methyl]-3-piperidin-1-iumyl]methanol IUPAC Name: [(3S)-1-[(2-bromophenyl)methyl]piperidin-1-ium-3-yl]methanol Traditional Name: [(3S)-1-(2-bromobenzyl)piperidin-1-ium-3-yl]methanol Formula: C13H19BrNO+ MolecularWeight: 285.20006

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CC=C2Br)CO

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CC=C2Br)CO

InChI

InChI=1S/C13H18BrNO/c14-13-6-2-1-5-12(13)9-15-7-3-4-11(8-15)10-16/h1-2,5-6,11,16H,3-4,7-10H2/p+1/t11-/m0/s1