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

Systemtic Name: 1-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C17H23N4O2+ MolecularWeight: 315.39012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)C(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)C(=O)N

InChI

InChI=1S/C17H22N4O2/c1-2-12-3-5-14(6-4-12)17-19-15(23-20-17)11-21-9-7-13(8-10-21)16(18)22/h3-6,13H,2,7-11H2,1H3,(H2,18,22)/p+1