[(3S)-1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-phenyl-methanone

Systemtic Name: [(3S)-1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-phenyl-methanone Openeye Name: [(3S)-1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-phenyl-methanone CAS Name: [(3S)-1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-piperidin-1-iumyl]-phenylmethanone IUPAC Name: [(3S)-1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-phenylmethanone Traditional Name: [(3S)-1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-3-yl]-phenyl-methanone Formula: C22H24N3O3+ MolecularWeight: 378.44426

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCCC(C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCC[C@@H](C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O3/c1-27-19-11-9-17(10-12-19)22-23-20(28-24-22)15-25-13-5-8-18(14-25)21(26)16-6-3-2-4-7-16/h2-4,6-7,9-12,18H,5,8,13-15H2,1H3/p+1/t18-/m0/s1