5-chloranyl-7-[[(2S)-2-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]quinolin-8-ol

Systemtic Name: 5-chloranyl-7-[[(2S)-2-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]quinolin-8-ol Openeye Name: 5-chloro-7-[[(2S)-2-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]quinolin-8-ol CAS Name: 5-chloro-7-[[(2S)-2-(hydroxymethyl)-1-piperidin-1-iumyl]methyl]-8-quinolinol IUPAC Name: 5-chloro-7-[[(2S)-2-(hydroxymethyl)piperidin-1-ium-1-yl]methyl]quinolin-8-ol Traditional Name: 5-chloro-7-[[(2S)-2-methylolpiperidin-1-ium-1-yl]methyl]quinolin-8-ol Formula: C16H20ClN2O2+ MolecularWeight: 307.7952

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CO)CC2=CC(=C3C=CC=NC3=C2O)Cl

Isomeric SMILES

C1CC[NH+]([C@@H](C1)CO)CC2=CC(=C3C=CC=NC3=C2O)Cl

InChI

InChI=1S/C16H19ClN2O2/c17-14-8-11(9-19-7-2-1-4-12(19)10-20)16(21)15-13(14)5-3-6-18-15/h3,5-6,8,12,20-21H,1-2,4,7,9-10H2/p+1/t12-/m0/s1