N-(2-cyclopentylpyrazol-3-yl)-3-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide

Systemtic Name: N-(2-cyclopentylpyrazol-3-yl)-3-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-3-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-3-[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]propanamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-3-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propanamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-3-[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]propionamide Formula: C18H31N4O+ MolecularWeight: 319.46494

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CCC(=O)NC2=CC=NN2C3CCCC3)C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CCC(=O)NC2=CC=NN2C3CCCC3)C

InChI

InChI=1S/C18H30N4O/c1-14-11-15(2)13-21(12-14)10-8-18(23)20-17-7-9-19-22(17)16-5-3-4-6-16/h7,9,14-16H,3-6,8,10-13H2,1-2H3,(H,20,23)/p+1/t14-,15-/m0/s1