6-(7-oxidanylideneazepan-2-yl)-3-oxabicyclo[3.2.0]hept-1(5)-ene-2,4-dione

Systemtic Name: 6-(7-oxidanylideneazepan-2-yl)-3-oxabicyclo[3.2.0]hept-1(5)-ene-2,4-dione Openeye Name: 6-(7-oxoazepan-2-yl)-3-oxabicyclo[3.2.0]hept-1(5)-ene-2,4-dione CAS Name: 6-(7-oxo-2-azepanyl)-3-oxabicyclo[3.2.0]hept-1(5)-ene-2,4-dione IUPAC Name: 6-(7-oxoazepan-2-yl)-3-oxabicyclo[3.2.0]hept-1(5)-ene-2,4-dione Traditional Name: 6-(7-ketoazepan-2-yl)-3-oxabicyclo[3.2.0]hept-1(5)-ene-2,4-quinone Formula: C12H13NO4 MolecularWeight: 235.23592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(C1)C2CC3=C2C(=O)OC3=O

Isomeric SMILES

C1CCC(=O)NC(C1)C2CC3=C2C(=O)OC3=O

InChI

InChI=1S/C12H13NO4/c14-9-4-2-1-3-8(13-9)6-5-7-10(6)12(16)17-11(7)15/h6,8H,1-5H2,(H,13,14)