5-(phenylmethyl)-3-[(2S)-piperidin-1-ium-2-yl]-1,2,4-oxadiazole chloride

Systemtic Name: 5-(phenylmethyl)-3-[(2S)-piperidin-1-ium-2-yl]-1,2,4-oxadiazole chloride Openeye Name: 5-benzyl-3-[(2S)-piperidin-1-ium-2-yl]-1,2,4-oxadiazole chloride CAS Name: 5-(phenylmethyl)-3-[(2S)-2-piperidin-1-iumyl]-1,2,4-oxadiazole chloride IUPAC Name: 5-benzyl-3-[(2S)-piperidin-1-ium-2-yl]-1,2,4-oxadiazole chloride Traditional Name: 5-benzyl-3-[(2S)-piperidin-1-ium-2-yl]-1,2,4-oxadiazole chloride Formula: C14H18ClN3O MolecularWeight: 279.76522

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH2+]C(C1)C2=NOC(=N2)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

C1CC[NH2+][C@@H](C1)C2=NOC(=N2)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C14H17N3O.ClH/c1-2-6-11(7-3-1)10-13-16-14(17-18-13)12-8-4-5-9-15-12;/h1-3,6-7,12,15H,4-5,8-10H2;1H/t12-;/m0./s1