(3E)-3-(2,2-dimethyl-1,3-dioxepan-5-ylidene)-1-ethanoyl-piperazine-2,5-dione

Systemtic Name: (3E)-3-(2,2-dimethyl-1,3-dioxepan-5-ylidene)-1-ethanoyl-piperazine-2,5-dione Openeye Name: (3E)-1-acetyl-3-(2,2-dimethyl-1,3-dioxepan-5-ylidene)piperazine-2,5-dione CAS Name: (3E)-1-acetyl-3-(2,2-dimethyl-1,3-dioxepan-5-ylidene)piperazine-2,5-dione IUPAC Name: (3E)-1-acetyl-3-(2,2-dimethyl-1,3-dioxepan-5-ylidene)piperazine-2,5-dione Traditional Name: (3E)-1-acetyl-3-(2,2-dimethyl-1,3-dioxepan-5-ylidene)piperazine-2,5-quinone Formula: C13H18N2O5 MolecularWeight: 282.29242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC(=O)NC(=C2CCOC(OC2)(C)C)C1=O

Isomeric SMILES

CC(=O)N1CC(=O)N/C(=C/2\CCOC(OC2)(C)C)/C1=O

InChI

InChI=1S/C13H18N2O5/c1-8(16)15-6-10(17)14-11(12(15)18)9-4-5-19-13(2,3)20-7-9/h4-7H2,1-3H3,(H,14,17)/b11-9+