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

Systemtic Name: 5-[N-(1,3-benzodioxol-5-ylmethyl)-C-methyl-carbonimidoyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[N-(1,3-benzodioxol-5-ylmethyl)-C-methyl-carbonimidoyl]-1,3-dimethyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-(1,3-benzodioxol-5-ylmethylimino)ethyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[N-(1,3-benzodioxol-5-ylmethyl)-C-methylcarbonimidoyl]-1,3-dimethyl-1,3-diazinane-2,4,6-trione Traditional Name: 1,3-dimethyl-5-(C-methyl-N-piperonyl-carbonimidoyl)barbituric acid Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NCC1=CC2=C(C=C1)OCO2)C3C(=O)N(C(=O)N(C3=O)C)C

Isomeric SMILES

CC(=NCC1=CC2=C(C=C1)OCO2)C3C(=O)N(C(=O)N(C3=O)C)C

InChI

InChI=1S/C16H17N3O5/c1-9(13-14(20)18(2)16(22)19(3)15(13)21)17-7-10-4-5-11-12(6-10)24-8-23-11/h4-6,13H,7-8H2,1-3H3