2-[[(3S)-1-[(2-methylpyrazol-3-yl)methyl]piperidin-1-ium-3-yl]oxymethyl]pyridine

Systemtic Name: 2-[[(3S)-1-[(2-methylpyrazol-3-yl)methyl]piperidin-1-ium-3-yl]oxymethyl]pyridine Openeye Name: 2-[[(3S)-1-[(2-methylpyrazol-3-yl)methyl]piperidin-1-ium-3-yl]oxymethyl]pyridine CAS Name: 2-[[(3S)-1-[(2-methyl-3-pyrazolyl)methyl]-3-piperidin-1-iumyl]oxymethyl]pyridine IUPAC Name: 2-[[(3S)-1-[(2-methylpyrazol-3-yl)methyl]piperidin-1-ium-3-yl]oxymethyl]pyridine Traditional Name: 2-[[(3S)-1-[(2-methylpyrazol-3-yl)methyl]piperidin-1-ium-3-yl]oxymethyl]pyridine Formula: C16H23N4O+ MolecularWeight: 287.38002

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=N1)C[NH+]2CCCC(C2)OCC3=CC=CC=N3

Isomeric SMILES

CN1C(=CC=N1)C[NH+]2CCC[C@@H](C2)OCC3=CC=CC=N3

InChI

InChI=1S/C16H22N4O/c1-19-15(7-9-18-19)11-20-10-4-6-16(12-20)21-13-14-5-2-3-8-17-14/h2-3,5,7-9,16H,4,6,10-13H2,1H3/p+1/t16-/m0/s1