5-(4-methoxyphenyl)-N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(4-methoxyphenyl)-N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-yl-ethyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(4-methoxyphenyl)-N-[(2S)-2-(5-methyl-2-furyl)-2-piperidin-1-ium-1-yl-ethyl]isoxazole-3-carboxamide CAS Name: 5-(4-methoxyphenyl)-N-[(2S)-2-(5-methyl-2-furanyl)-2-(1-piperidin-1-iumyl)ethyl]-3-isoxazolecarboxamide IUPAC Name: 5-(4-methoxyphenyl)-N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ium-1-ylethyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(4-methoxyphenyl)-N-[(2S)-2-(5-methyl-2-furyl)-2-piperidin-1-ium-1-yl-ethyl]isoxazole-3-carboxamide Formula: C23H28N3O4+ MolecularWeight: 410.48612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC(=O)C2=NOC(=C2)C3=CC=C(C=C3)OC)[NH+]4CCCCC4

Isomeric SMILES

CC1=CC=C(O1)[C@H](CNC(=O)C2=NOC(=C2)C3=CC=C(C=C3)OC)[NH+]4CCCCC4

InChI

InChI=1S/C23H27N3O4/c1-16-6-11-21(29-16)20(26-12-4-3-5-13-26)15-24-23(27)19-14-22(30-25-19)17-7-9-18(28-2)10-8-17/h6-11,14,20H,3-5,12-13,15H2,1-2H3,(H,24,27)/p+1/t20-/m0/s1