3-(3-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2,4-oxadiazole-5-carboxamide

Systemtic Name: 3-(3-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2,4-oxadiazole-5-carboxamide Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-(m-tolyl)-1,2,4-oxadiazole-5-carboxamide CAS Name: 3-(3-methylphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-1,2,4-oxadiazole-5-carboxamide IUPAC Name: 3-(3-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)-1,2,4-oxadiazole-5-carboxamide Traditional Name: N-(3-morpholin-4-ium-4-ylpropyl)-3-(m-tolyl)-1,2,4-oxadiazole-5-carboxamide Formula: C17H23N4O3+ MolecularWeight: 331.38952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)C(=O)NCCC[NH+]3CCOCC3

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)C(=O)NCCC[NH+]3CCOCC3

InChI

InChI=1S/C17H22N4O3/c1-13-4-2-5-14(12-13)15-19-17(24-20-15)16(22)18-6-3-7-21-8-10-23-11-9-21/h2,4-5,12H,3,6-11H2,1H3,(H,18,22)/p+1