2-[(4-chloranyl-3-methyl-phenoxy)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole

Systemtic Name: 2-[(4-chloranyl-3-methyl-phenoxy)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Openeye Name: 2-[(4-chloro-3-methyl-phenoxy)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole CAS Name: 2-[(4-chloro-3-methylphenoxy)methyl]-5-(4-piperidin-1-iumyl)-1,3,4-oxadiazole IUPAC Name: 2-[(4-chloro-3-methylphenoxy)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Traditional Name: 2-[(4-chloro-3-methyl-phenoxy)methyl]-5-piperidin-1-ium-4-yl-1,3,4-oxadiazole Formula: C15H19ClN3O2+ MolecularWeight: 308.78326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=NN=C(O2)C3CC[NH2+]CC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=NN=C(O2)C3CC[NH2+]CC3)Cl

InChI

InChI=1S/C15H18ClN3O2/c1-10-8-12(2-3-13(10)16)20-9-14-18-19-15(21-14)11-4-6-17-7-5-11/h2-3,8,11,17H,4-7,9H2,1H3/p+1