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

Systemtic Name: N-methyl-2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(1,2-oxazol-3-ylmethyl)ethanamide Openeye Name: N-(isoxazol-3-ylmethyl)-N-methyl-2-[(2R)-1-(2-naphthylmethyl)-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-(3-isoxazolylmethyl)-N-methyl-2-[(2R)-1-(2-naphthalenylmethyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-methyl-2-[(2R)-1-(naphthalen-2-ylmethyl)-3-oxopiperazin-1-ium-2-yl]-N-(1,2-oxazol-3-ylmethyl)acetamide Traditional Name: N-(isoxazol-3-ylmethyl)-2-[(2R)-3-keto-1-(2-naphthylmethyl)piperazin-1-ium-2-yl]-N-methyl-acetamide Formula: C22H25N4O3+ MolecularWeight: 393.4589

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NOC=C1)C(=O)CC2C(=O)NCC[NH+]2CC3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CN(CC1=NOC=C1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C22H24N4O3/c1-25(15-19-8-11-29-24-19)21(27)13-20-22(28)23-9-10-26(20)14-16-6-7-17-4-2-3-5-18(17)12-16/h2-8,11-12,20H,9-10,13-15H2,1H3,(H,23,28)/p+1/t20-/m1/s1