(2R)-1-cyclopentyl-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-cyclopentyl-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidin-1-ium-2-carboxamide Openeye Name: (2R)-1-cyclopentyl-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidin-1-ium-2-carboxamide CAS Name: (2R)-1-cyclopentyl-N-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-1-cyclopentyl-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-cyclopentyl-N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]piperidin-1-ium-2-carboxamide Formula: C22H31N4O+ MolecularWeight: 367.50774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)C3CCCC[NH+]3C4CCCC4)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)[C@H]3CCCC[NH+]3C4CCCC4)C

InChI

InChI=1S/C22H30N4O/c1-16-15-17(2)26(24-16)20-12-10-18(11-13-20)23-22(27)21-9-5-6-14-25(21)19-7-3-4-8-19/h10-13,15,19,21H,3-9,14H2,1-2H3,(H,23,27)/p+1/t21-/m1/s1