5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]barbituric acid Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)NC(=O)NC1=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC(=C1C(=O)NC(=O)NC1=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C14H13N3O5/c1-2-8(11-12(18)16-14(20)17-13(11)19)15-7-3-4-9-10(5-7)22-6-21-9/h3-5,15H,2,6H2,1H3,(H2,16,17,18,19,20)