N-(2,2-dimethoxyethyl)-4-oxidanylidene-4-piperazin-4-ium-1-yl-butanamide

Systemtic Name: N-(2,2-dimethoxyethyl)-4-oxidanylidene-4-piperazin-4-ium-1-yl-butanamide Openeye Name: N-(2,2-dimethoxyethyl)-4-oxo-4-piperazin-4-ium-1-yl-butanamide CAS Name: N-(2,2-dimethoxyethyl)-4-oxo-4-(1-piperazin-4-iumyl)butanamide IUPAC Name: N-(2,2-dimethoxyethyl)-4-oxo-4-piperazin-4-ium-1-ylbutanamide Traditional Name: N-(2,2-dimethoxyethyl)-4-keto-4-piperazin-4-ium-1-yl-butyramide Formula: C12H24N3O4+ MolecularWeight: 274.33666

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Descriptors Computed from Structure

Canonical SMILES:

COC(CNC(=O)CCC(=O)N1CC[NH2+]CC1)OC

Isomeric SMILES

COC(CNC(=O)CCC(=O)N1CC[NH2+]CC1)OC

InChI

InChI=1S/C12H23N3O4/c1-18-12(19-2)9-14-10(16)3-4-11(17)15-7-5-13-6-8-15/h12-13H,3-9H2,1-2H3,(H,14,16)/p+1