2-[(2R)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-[(3-pyrazol-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(2R)-1-cyclopentyl-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-[(3-pyrazol-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[(2R)-1-cyclopentyl-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-[(3-pyrazol-1-ylphenyl)methyl]acetamide CAS Name: 2-[(2R)-1-cyclopentyl-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-[[3-(1-pyrazolyl)phenyl]methyl]acetamide IUPAC Name: 2-[(2R)-1-cyclopentyl-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-[(3-pyrazol-1-ylphenyl)methyl]acetamide Traditional Name: 2-[(2R)-1-cyclopentyl-3-keto-piperazin-1-ium-2-yl]-N-methyl-N-(3-pyrazol-1-ylbenzyl)acetamide Formula: C22H30N5O2+ MolecularWeight: 396.5059

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)N2C=CC=N2)C(=O)CC3C(=O)NCC[NH+]3C4CCCC4

Isomeric SMILES

CN(CC1=CC(=CC=C1)N2C=CC=N2)C(=O)C[C@@H]3C(=O)NCC[NH+]3C4CCCC4

InChI

InChI=1S/C22H29N5O2/c1-25(16-17-6-4-9-19(14-17)27-12-5-10-24-27)21(28)15-20-22(29)23-11-13-26(20)18-7-2-3-8-18/h4-6,9-10,12,14,18,20H,2-3,7-8,11,13,15-16H2,1H3,(H,23,29)/p+1/t20-/m1/s1