N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[4-[2-(4-hydroxyphenyl)ethyl]piperidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[4-[2-(4-hydroxyphenyl)ethyl]piperidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-tert-butylisoxazol-5-yl)-2-[4-[2-(4-hydroxyphenyl)ethyl]piperidin-1-ium-1-yl]acetamide CAS Name: N-(3-tert-butyl-5-isoxazolyl)-2-[4-[2-(4-hydroxyphenyl)ethyl]-1-piperidin-1-iumyl]acetamide IUPAC Name: N-(3-tert-butyl-1,2-oxazol-5-yl)-2-[4-[2-(4-hydroxyphenyl)ethyl]piperidin-1-ium-1-yl]acetamide Traditional Name: N-(3-tert-butylisoxazol-5-yl)-2-[4-[2-(4-hydroxyphenyl)ethyl]piperidin-1-ium-1-yl]acetamide Formula: C22H32N3O3+ MolecularWeight: 386.50778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1)NC(=O)C[NH+]2CCC(CC2)CCC3=CC=C(C=C3)O

Isomeric SMILES

CC(C)(C)C1=NOC(=C1)NC(=O)C[NH+]2CCC(CC2)CCC3=CC=C(C=C3)O

InChI

InChI=1S/C22H31N3O3/c1-22(2,3)19-14-21(28-24-19)23-20(27)15-25-12-10-17(11-13-25)5-4-16-6-8-18(26)9-7-16/h6-9,14,17,26H,4-5,10-13,15H2,1-3H3,(H,23,27)/p+1