N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-2-(3-methylpyrazol-1-yl)ethanamide

Systemtic Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-2-(3-methylpyrazol-1-yl)ethanamide Openeye Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-2-(3-methylpyrazol-1-yl)acetamide CAS Name: N-[(3S)-1-(cyclohexylmethyl)-3-piperidin-1-iumyl]-2-(3-methyl-1-pyrazolyl)acetamide IUPAC Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-2-(3-methylpyrazol-1-yl)acetamide Traditional Name: N-[(3S)-1-(cyclohexylmethyl)piperidin-1-ium-3-yl]-2-(3-methylpyrazol-1-yl)acetamide Formula: C18H31N4O+ MolecularWeight: 319.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CC(=O)NC2CCC[NH+](C2)CC3CCCCC3

Isomeric SMILES

CC1=NN(C=C1)CC(=O)N[C@H]2CCC[NH+](C2)CC3CCCCC3

InChI

InChI=1S/C18H30N4O/c1-15-9-11-22(20-15)14-18(23)19-17-8-5-10-21(13-17)12-16-6-3-2-4-7-16/h9,11,16-17H,2-8,10,12-14H2,1H3,(H,19,23)/p+1/t17-/m0/s1