[4-[(3S)-3-ethyl-3-(hydroxymethyl)piperidin-1-yl]pyridin-1-ium-2-yl]methanol

Systemtic Name: [4-[(3S)-3-ethyl-3-(hydroxymethyl)piperidin-1-yl]pyridin-1-ium-2-yl]methanol Openeye Name: [4-[(3S)-3-ethyl-3-(hydroxymethyl)-1-piperidyl]pyridin-1-ium-2-yl]methanol CAS Name: [4-[(3S)-3-ethyl-3-(hydroxymethyl)-1-piperidinyl]-2-pyridin-1-iumyl]methanol IUPAC Name: [4-[(3S)-3-ethyl-3-(hydroxymethyl)piperidin-1-yl]pyridin-1-ium-2-yl]methanol Traditional Name: [4-[(3S)-3-ethyl-3-methylol-piperidino]pyridin-1-ium-2-yl]methanol Formula: C14H23N2O2+ MolecularWeight: 251.34462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CCCN(C1)C2=CC(=[NH+]C=C2)CO)CO

Isomeric SMILES

CC[C@@]1(CCCN(C1)C2=CC(=[NH+]C=C2)CO)CO

InChI

InChI=1S/C14H22N2O2/c1-2-14(11-18)5-3-7-16(10-14)13-4-6-15-12(8-13)9-17/h4,6,8,17-18H,2-3,5,7,9-11H2,1H3/p+1/t14-/m0/s1