(5S)-3-(4-methoxyphenyl)-N-(1-methylpiperidin-1-ium-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: (5S)-3-(4-methoxyphenyl)-N-(1-methylpiperidin-1-ium-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: (5S)-3-(4-methoxyphenyl)-N-(1-methylpiperidin-1-ium-4-yl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: (5S)-3-(4-methoxyphenyl)-N-(1-methyl-4-piperidin-1-iumyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: (5S)-3-(4-methoxyphenyl)-N-(1-methylpiperidin-1-ium-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: (5S)-3-(4-methoxyphenyl)-N-(1-methylpiperidin-1-ium-4-yl)-2-isoxazoline-5-carboxamide Formula: C17H24N3O3+ MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC(=O)C2CC(=NO2)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+]1CCC(CC1)NC(=O)[C@@H]2CC(=NO2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C17H23N3O3/c1-20-9-7-13(8-10-20)18-17(21)16-11-15(19-23-16)12-3-5-14(22-2)6-4-12/h3-6,13,16H,7-11H2,1-2H3,(H,18,21)/p+1/t16-/m0/s1