4-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-ol

Systemtic Name: 4-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-ol Openeye Name: 4-[(3-phenylisoxazol-5-yl)methyl]-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-ol CAS Name: 4-[(3-phenyl-5-isoxazolyl)methyl]-1-[3-(1-pyrazolyl)propyl]-4-piperidin-1-iumol IUPAC Name: 4-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-ol Traditional Name: 4-[(3-phenylisoxazol-5-yl)methyl]-1-(3-pyrazol-1-ylpropyl)piperidin-1-ium-4-ol Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(CC2=CC(=NO2)C3=CC=CC=C3)O)CCCN4C=CC=N4

Isomeric SMILES

C1C[NH+](CCC1(CC2=CC(=NO2)C3=CC=CC=C3)O)CCCN4C=CC=N4

InChI

InChI=1S/C21H26N4O2/c26-21(17-19-16-20(23-27-19)18-6-2-1-3-7-18)8-14-24(15-9-21)11-5-13-25-12-4-10-22-25/h1-4,6-7,10,12,16,26H,5,8-9,11,13-15,17H2/p+1