5-[(2-piperidin-1-ium-1-ylethylamino)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(2-piperidin-1-ium-1-ylethylamino)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(2-piperidin-1-ium-1-ylethylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[[2-(1-piperidin-1-iumyl)ethylamino]methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(2-piperidin-1-ium-1-ylethylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[(2-piperidin-1-ium-1-ylethylamino)methylene]barbituric acid Formula: C12H19N4O3+ MolecularWeight: 267.30426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCNC=C2C(=O)NC(=O)NC2=O

Isomeric SMILES

C1CC[NH+](CC1)CCNC=C2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C12H18N4O3/c17-10-9(11(18)15-12(19)14-10)8-13-4-7-16-5-2-1-3-6-16/h8,13H,1-7H2,(H2,14,15,17,18,19)/p+1