3-ethyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-1,2-oxazole-5-carboxamide

Systemtic Name: 3-ethyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-1,2-oxazole-5-carboxamide Openeye Name: 3-ethyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]isoxazole-5-carboxamide CAS Name: 3-ethyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]-3-piperidin-1-iumyl]-5-isoxazolecarboxamide IUPAC Name: 3-ethyl-N-[(3S)-1-[(3-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-1,2-oxazole-5-carboxamide Traditional Name: 3-ethyl-N-[(3S)-1-m-anisylpiperidin-1-ium-3-yl]isoxazole-5-carboxamide Formula: C19H26N3O3+ MolecularWeight: 344.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1)C(=O)NC2CCC[NH+](C2)CC3=CC(=CC=C3)OC

Isomeric SMILES

CCC1=NOC(=C1)C(=O)N[C@H]2CCC[NH+](C2)CC3=CC(=CC=C3)OC

InChI

InChI=1S/C19H25N3O3/c1-3-15-11-18(25-21-15)19(23)20-16-7-5-9-22(13-16)12-14-6-4-8-17(10-14)24-2/h4,6,8,10-11,16H,3,5,7,9,12-13H2,1-2H3,(H,20,23)/p+1/t16-/m0/s1