N-(2-hydroxyphenyl)-1-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyphenyl)-1-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyphenyl)-1-[[5-(2-thienyl)isoxazol-3-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[(5-thiophen-2-yl-3-isoxazolyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyphenyl)-1-[[5-(2-thienyl)isoxazol-3-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C20H22N3O3S+ MolecularWeight: 384.47198

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2O)CC3=NOC(=C3)C4=CC=CS4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CC=CC=C2O)CC3=NOC(=C3)C4=CC=CS4

InChI

InChI=1S/C20H21N3O3S/c24-17-5-2-1-4-16(17)21-20(25)14-7-9-23(10-8-14)13-15-12-18(26-22-15)19-6-3-11-27-19/h1-6,11-12,14,24H,7-10,13H2,(H,21,25)/p+1