N-[[(3R)-1-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]-5-methyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[[(3R)-1-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]-5-methyl-1,2-oxazole-3-carboxamide Openeye Name: N-[[(3R)-1-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]-5-methyl-isoxazole-3-carboxamide CAS Name: N-[[(3R)-1-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]-3-piperidin-1-iumyl]methyl]-5-methyl-3-isoxazolecarboxamide IUPAC Name: N-[[(3R)-1-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]-5-methyl-1,2-oxazole-3-carboxamide Traditional Name: N-[[(3R)-1-[(5-cyclohexyl-1H-pyrazol-4-yl)methyl]piperidin-1-ium-3-yl]methyl]-5-methyl-isoxazole-3-carboxamide Formula: C21H32N5O2+ MolecularWeight: 386.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C(=O)NCC2CCC[NH+](C2)CC3=C(NN=C3)C4CCCCC4

Isomeric SMILES

CC1=CC(=NO1)C(=O)NC[C@H]2CCC[NH+](C2)CC3=C(NN=C3)C4CCCCC4

InChI

InChI=1S/C21H31N5O2/c1-15-10-19(25-28-15)21(27)22-11-16-6-5-9-26(13-16)14-18-12-23-24-20(18)17-7-3-2-4-8-17/h10,12,16-17H,2-9,11,13-14H2,1H3,(H,22,27)(H,23,24)/p+1/t16-/m1/s1