(3S)-1-(1-pyrimidin-2-ylpiperidin-4-yl)piperidin-1-ium-3-ol

Systemtic Name: (3S)-1-(1-pyrimidin-2-ylpiperidin-4-yl)piperidin-1-ium-3-ol Openeye Name: (3S)-1-(1-pyrimidin-2-yl-4-piperidyl)piperidin-1-ium-3-ol CAS Name: (3S)-1-[1-(2-pyrimidinyl)-4-piperidinyl]-3-piperidin-1-iumol IUPAC Name: (3S)-1-(1-pyrimidin-2-ylpiperidin-4-yl)piperidin-1-ium-3-ol Traditional Name: (3S)-1-[1-(2-pyrimidyl)-4-piperidyl]piperidin-1-ium-3-ol Formula: C14H23N4O+ MolecularWeight: 263.35862

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)C2CCN(CC2)C3=NC=CC=N3)O

Isomeric SMILES

C1C[C@@H](C[NH+](C1)C2CCN(CC2)C3=NC=CC=N3)O

InChI

InChI=1S/C14H22N4O/c19-13-3-1-8-18(11-13)12-4-9-17(10-5-12)14-15-6-2-7-16-14/h2,6-7,12-13,19H,1,3-5,8-11H2/p+1/t13-/m0/s1