[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-(3-piperidin-1-ium-1-ylpropyl)azanium

Systemtic Name: [3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-(3-piperidin-1-ium-1-ylpropyl)azanium Openeye Name: [3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-(3-piperidin-1-ium-1-ylpropyl)ammonium CAS Name: [3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-[3-(1-piperidin-1-iumyl)propyl]ammonium IUPAC Name: [3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-(3-piperidin-1-ium-1-ylpropyl)azanium Traditional Name: [3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl-methyl-(3-piperidin-1-ium-1-ylpropyl)ammonium Formula: C18H27ClN4O+2 MolecularWeight: 350.88618

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC[NH+]1CCCCC1)CC2=NC(=NO2)C3=CC(=CC=C3)Cl

Isomeric SMILES

C[NH+](CCC[NH+]1CCCCC1)CC2=NC(=NO2)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H25ClN4O/c1-22(9-6-12-23-10-3-2-4-11-23)14-17-20-18(21-24-17)15-7-5-8-16(19)13-15/h5,7-8,13H,2-4,6,9-12,14H2,1H3/p+2