3-(2-methoxyphenyl)-5-[(3S)-1-propan-2-ylpiperidin-1-ium-3-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(2-methoxyphenyl)-5-[(3S)-1-propan-2-ylpiperidin-1-ium-3-yl]-1,2,4-oxadiazole Openeye Name: 5-[(3S)-1-isopropylpiperidin-1-ium-3-yl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole CAS Name: 3-(2-methoxyphenyl)-5-[(3S)-1-propan-2-yl-3-piperidin-1-iumyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-methoxyphenyl)-5-[(3S)-1-propan-2-ylpiperidin-1-ium-3-yl]-1,2,4-oxadiazole Traditional Name: 5-[(3S)-1-isopropylpiperidin-1-ium-3-yl]-3-(2-methoxyphenyl)-1,2,4-oxadiazole Formula: C17H24N3O2+ MolecularWeight: 302.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCCC(C1)C2=NC(=NO2)C3=CC=CC=C3OC

Isomeric SMILES

CC(C)[NH+]1CCC[C@@H](C1)C2=NC(=NO2)C3=CC=CC=C3OC

InChI

InChI=1S/C17H23N3O2/c1-12(2)20-10-6-7-13(11-20)17-18-16(19-22-17)14-8-4-5-9-15(14)21-3/h4-5,8-9,12-13H,6-7,10-11H2,1-3H3/p+1/t13-/m0/s1