2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)ethanamide

Systemtic Name: 2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)ethanamide Openeye Name: 2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)acetamide CAS Name: 2-[4-(1,3-benzoxazol-2-yl)-1-piperidin-1-iumyl]-N-(2-cyclopentyl-3-pyrazolyl)acetamide IUPAC Name: 2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)acetamide Traditional Name: 2-[4-(1,3-benzoxazol-2-yl)piperidin-1-ium-1-yl]-N-(2-cyclopentylpyrazol-3-yl)acetamide Formula: C22H28N5O2+ MolecularWeight: 394.49002

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=CC=N2)NC(=O)C[NH+]3CCC(CC3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CCC(C1)N2C(=CC=N2)NC(=O)C[NH+]3CCC(CC3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C22H27N5O2/c28-21(25-20-9-12-23-27(20)17-5-1-2-6-17)15-26-13-10-16(11-14-26)22-24-18-7-3-4-8-19(18)29-22/h3-4,7-9,12,16-17H,1-2,5-6,10-11,13-15H2,(H,25,28)/p+1