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

Systemtic Name: 5-[1-(1,3-benzodioxol-5-ylmethylamino)propylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[1-(1,3-benzodioxol-5-ylmethylamino)propylidene]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-(1,3-benzodioxol-5-ylmethylamino)propylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[1-(1,3-benzodioxol-5-ylmethylamino)propylidene]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dimethyl-5-[1-(piperonylamino)propylidene]barbituric acid Formula: C17H19N3O5 MolecularWeight: 345.34986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C(=O)N(C(=O)N(C1=O)C)C)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCC(=C1C(=O)N(C(=O)N(C1=O)C)C)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H19N3O5/c1-4-11(14-15(21)19(2)17(23)20(3)16(14)22)18-8-10-5-6-12-13(7-10)25-9-24-12/h5-7,18H,4,8-9H2,1-3H3