5-[N-(1,3-benzodioxol-5-ylmethyl)-C-methyl-carbonimidoyl]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[N-(1,3-benzodioxol-5-ylmethyl)-C-methyl-carbonimidoyl]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[N-(1,3-benzodioxol-5-ylmethyl)-C-methyl-carbonimidoyl]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-(1,3-benzodioxol-5-ylmethylimino)ethyl]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[N-(1,3-benzodioxol-5-ylmethyl)-C-methylcarbonimidoyl]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(C-methyl-N-piperonyl-carbonimidoyl)barbituric acid Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC1=CC2=C(C=C1)OCO2)C3C(=O)NC(=O)NC3=O

Isomeric SMILES

CC(=NCC1=CC2=C(C=C1)OCO2)C3C(=O)NC(=O)NC3=O

InChI

InChI=1S/C14H13N3O5/c1-7(11-12(18)16-14(20)17-13(11)19)15-5-8-2-3-9-10(4-8)22-6-21-9/h2-4,11H,5-6H2,1H3,(H2,16,17,18,19,20)