4-[[3-(3-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidin-1-ium-4-ol

Systemtic Name: 4-[[3-(3-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidin-1-ium-4-ol Openeye Name: 4-[[3-(3-methoxyphenyl)isoxazol-5-yl]methyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidin-1-ium-4-ol CAS Name: 4-[[3-(3-methoxyphenyl)-5-isoxazolyl]methyl]-1-[(2-methyl-5-pyrimidinyl)methyl]-4-piperidin-1-iumol IUPAC Name: 4-[[3-(3-methoxyphenyl)-1,2-oxazol-5-yl]methyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidin-1-ium-4-ol Traditional Name: 4-[[3-(3-methoxyphenyl)isoxazol-5-yl]methyl]-1-[(2-methylpyrimidin-5-yl)methyl]piperidin-1-ium-4-ol Formula: C22H27N4O3+ MolecularWeight: 395.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=N1)C[NH+]2CCC(CC2)(CC3=CC(=NO3)C4=CC(=CC=C4)OC)O

Isomeric SMILES

CC1=NC=C(C=N1)C[NH+]2CCC(CC2)(CC3=CC(=NO3)C4=CC(=CC=C4)OC)O

InChI

InChI=1S/C22H26N4O3/c1-16-23-13-17(14-24-16)15-26-8-6-22(27,7-9-26)12-20-11-21(25-29-20)18-4-3-5-19(10-18)28-2/h3-5,10-11,13-14,27H,6-9,12,15H2,1-2H3/p+1