2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(3,5-dimethylisoxazole-4-carbonyl)piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(3,5-dimethyl-1,2-oxazole-4-carbonyl)piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(3,5-dimethylisoxazole-4-carbonyl)piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C16H25N4O3+ MolecularWeight: 321.3947

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)N2CC[NH+](CC2)CC(=O)N3CCCC3

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N2CC[NH+](CC2)CC(=O)N3CCCC3

InChI

InChI=1S/C16H24N4O3/c1-12-15(13(2)23-17-12)16(22)20-9-7-18(8-10-20)11-14(21)19-5-3-4-6-19/h3-11H2,1-2H3/p+1