1-[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]-N-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]-N-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-[1-(1,3-benzoxazol-2-yl)-4-piperidyl]-N-(isoxazol-3-ylmethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-[1-(1,3-benzoxazol-2-yl)-4-piperidinyl]-N-(3-isoxazolylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-(1,3-benzoxazol-2-yl)piperidin-4-yl]-N-(1,2-oxazol-3-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-[1-(1,3-benzoxazol-2-yl)-4-piperidyl]-N-(isoxazol-3-ylmethyl)piperidin-1-ium-4-carboxamide Formula: C22H28N5O3+ MolecularWeight: 410.48942

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=NOC=C2)C3CCN(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=NOC=C2)C3CCN(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C22H27N5O3/c28-21(23-15-17-9-14-29-25-17)16-5-10-26(11-6-16)18-7-12-27(13-8-18)22-24-19-3-1-2-4-20(19)30-22/h1-4,9,14,16,18H,5-8,10-13,15H2,(H,23,28)/p+1