3,5-dimethyl-4-[[4-(pyrazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[[4-(pyrazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[[4-(pyrazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]isoxazole CAS Name: 3,5-dimethyl-4-[[4-(1-pyrazolylmethyl)-1-piperidin-1-iumyl]methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[[4-(pyrazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[[4-(pyrazol-1-ylmethyl)piperidin-1-ium-1-yl]methyl]isoxazole Formula: C15H23N4O+ MolecularWeight: 275.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C[NH+]2CCC(CC2)CN3C=CC=N3

Isomeric SMILES

CC1=C(C(=NO1)C)C[NH+]2CCC(CC2)CN3C=CC=N3

InChI

InChI=1S/C15H22N4O/c1-12-15(13(2)20-17-12)11-18-8-4-14(5-9-18)10-19-7-3-6-16-19/h3,6-7,14H,4-5,8-11H2,1-2H3/p+1