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

Systemtic Name: 3-[(4-chlorophenyl)methyl]-5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazole Openeye Name: 3-[(4-chlorophenyl)methyl]-5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazole CAS Name: 3-[(4-chlorophenyl)methyl]-5-[(3S)-3-piperidin-1-iumyl]-1,2,4-oxadiazole IUPAC Name: 3-[(4-chlorophenyl)methyl]-5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazole Traditional Name: 3-(4-chlorobenzyl)-5-[(3S)-piperidin-1-ium-3-yl]-1,2,4-oxadiazole Formula: C14H17ClN3O+ MolecularWeight: 278.75728

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)C2=NC(=NO2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)C2=NC(=NO2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H16ClN3O/c15-12-5-3-10(4-6-12)8-13-17-14(19-18-13)11-2-1-7-16-9-11/h3-6,11,16H,1-2,7-9H2/p+1/t11-/m0/s1