N-methyl-2-[(2R)-3-oxidanylidene-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-[(3-propyl-1H-pyrazol-5-yl)methyl]ethanamide

Systemtic Name: N-methyl-2-[(2R)-3-oxidanylidene-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-[(3-propyl-1H-pyrazol-5-yl)methyl]ethanamide Openeye Name: N-methyl-2-[(2R)-3-oxo-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-[(3-propyl-1H-pyrazol-5-yl)methyl]acetamide CAS Name: N-methyl-2-[(2R)-3-oxo-1-(3-phenylpropyl)-2-piperazin-1-iumyl]-N-[(3-propyl-1H-pyrazol-5-yl)methyl]acetamide IUPAC Name: N-methyl-2-[(2R)-3-oxo-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-[(3-propyl-1H-pyrazol-5-yl)methyl]acetamide Traditional Name: 2-[(2R)-3-keto-1-(3-phenylpropyl)piperazin-1-ium-2-yl]-N-methyl-N-[(3-propyl-1H-pyrazol-5-yl)methyl]acetamide Formula: C23H34N5O2+ MolecularWeight: 412.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=C1)CN(C)C(=O)CC2C(=O)NCC[NH+]2CCCC3=CC=CC=C3

Isomeric SMILES

CCCC1=NNC(=C1)CN(C)C(=O)C[C@@H]2C(=O)NCC[NH+]2CCCC3=CC=CC=C3

InChI

InChI=1S/C23H33N5O2/c1-3-8-19-15-20(26-25-19)17-27(2)22(29)16-21-23(30)24-12-14-28(21)13-7-11-18-9-5-4-6-10-18/h4-6,9-10,15,21H,3,7-8,11-14,16-17H2,1-2H3,(H,24,30)(H,25,26)/p+1/t21-/m1/s1