ethyl 1-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[[3-(phenoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C18H24N3O4+ MolecularWeight: 346.40086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=NC(=NO2)COC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=NC(=NO2)COC3=CC=CC=C3

InChI

InChI=1S/C18H23N3O4/c1-2-23-18(22)14-8-10-21(11-9-14)12-17-19-16(20-25-17)13-24-15-6-4-3-5-7-15/h3-7,14H,2,8-13H2,1H3/p+1