4-[(3S)-3-oxidanyl-1-piperidin-1-ium-1-yl-nonan-3-yl]phenol

Systemtic Name: 4-[(3S)-3-oxidanyl-1-piperidin-1-ium-1-yl-nonan-3-yl]phenol Openeye Name: 4-[(1S)-1-hydroxy-1-(2-piperidin-1-ium-1-ylethyl)heptyl]phenol CAS Name: 4-[(3S)-3-hydroxy-1-(1-piperidin-1-iumyl)nonan-3-yl]phenol IUPAC Name: 4-[(3S)-3-hydroxy-1-piperidin-1-ium-1-ylnonan-3-yl]phenol Traditional Name: 4-[(1S)-1-hydroxy-1-(2-piperidin-1-ium-1-ylethyl)heptyl]phenol Formula: C20H34NO2+ MolecularWeight: 320.48946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC[NH+]1CCCCC1)(C2=CC=C(C=C2)O)O

Isomeric SMILES

CCCCCC[C@](CC[NH+]1CCCCC1)(C2=CC=C(C=C2)O)O

InChI

InChI=1S/C20H33NO2/c1-2-3-4-6-13-20(23,18-9-11-19(22)12-10-18)14-17-21-15-7-5-8-16-21/h9-12,22-23H,2-8,13-17H2,1H3/p+1/t20-/m0/s1