2,4-bis(chloranyl)-6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2,4-bis(chloranyl)-6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenol Openeye Name: 2,4-dichloro-6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenol CAS Name: 2,4-dichloro-6-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]phenol IUPAC Name: 2,4-dichloro-6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenol Traditional Name: 2,4-dichloro-6-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenol Formula: C13H18Cl2NO+ MolecularWeight: 275.19412

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=CC(=CC(=C2O)Cl)Cl

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=CC(=CC(=C2O)Cl)Cl

InChI

InChI=1S/C13H17Cl2NO/c1-9-3-2-4-16(7-9)8-10-5-11(14)6-12(15)13(10)17/h5-6,9,17H,2-4,7-8H2,1H3/p+1/t9-/m0/s1