N-methyl-N-(1,2-oxazol-5-ylmethyl)-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-methyl-N-(1,2-oxazol-5-ylmethyl)-2-[(2R)-3-oxidanylidene-1-phenethyl-piperazin-1-ium-2-yl]ethanamide Openeye Name: N-(isoxazol-5-ylmethyl)-N-methyl-2-[(2R)-3-oxo-1-phenethyl-piperazin-1-ium-2-yl]acetamide CAS Name: N-(5-isoxazolylmethyl)-N-methyl-2-[(2R)-3-oxo-1-phenethyl-2-piperazin-1-iumyl]acetamide IUPAC Name: N-methyl-N-(1,2-oxazol-5-ylmethyl)-2-[(2R)-3-oxo-1-phenethylpiperazin-1-ium-2-yl]acetamide Traditional Name: N-(isoxazol-5-ylmethyl)-2-[(2R)-3-keto-1-phenethyl-piperazin-1-ium-2-yl]-N-methyl-acetamide Formula: C19H25N4O3+ MolecularWeight: 357.4268

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=NO1)C(=O)CC2C(=O)NCC[NH+]2CCC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=NO1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CCC3=CC=CC=C3

InChI

InChI=1S/C19H24N4O3/c1-22(14-16-7-9-21-26-16)18(24)13-17-19(25)20-10-12-23(17)11-8-15-5-3-2-4-6-15/h2-7,9,17H,8,10-14H2,1H3,(H,20,25)/p+1/t17-/m1/s1