5-(azepan-1-ylcarbonyl)-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione

Systemtic Name: 5-(azepan-1-ylcarbonyl)-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione Openeye Name: 5-(azepane-1-carbonyl)-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione CAS Name: 5-[1-azepanyl(oxo)methyl]-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione IUPAC Name: 5-(azepane-1-carbonyl)-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-2,4-dione Traditional Name: 5-(azepane-1-carbonyl)-1,8,8-trimethyl-3-oxabicyclo[3.2.1]octane-2,4-quinone Formula: C17H25NO4 MolecularWeight: 307.3847

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2(CCC1(C(=O)OC2=O)C(=O)N3CCCCCC3)C)C

Isomeric SMILES

CC1(C2(CCC1(C(=O)OC2=O)C(=O)N3CCCCCC3)C)C

InChI

InChI=1S/C17H25NO4/c1-15(2)16(3)8-9-17(15,14(21)22-13(16)20)12(19)18-10-6-4-5-7-11-18/h4-11H2,1-3H3