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

Systemtic Name: [1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-yl]-piperidin-1-yl-methanone Openeye Name: [1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-yl]-(1-piperidyl)methanone CAS Name: [1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-piperidin-1-iumyl]-(1-piperidinyl)methanone IUPAC Name: [1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-yl]-piperidin-1-ylmethanone Traditional Name: [1-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-yl]-piperidino-methanone Formula: C21H29N4O3+ MolecularWeight: 385.47996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)C(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)C(=O)N4CCCCC4

InChI

InChI=1S/C21H28N4O3/c1-27-18-7-5-16(6-8-18)20-22-19(28-23-20)15-24-13-9-17(10-14-24)21(26)25-11-3-2-4-12-25/h5-8,17H,2-4,9-15H2,1H3/p+1