3-(1,4-diazabicyclo[3.2.2]nonan-4-ylcarbonyl)chromen-4-one; methanoic acid

Systemtic Name: 3-(1,4-diazabicyclo[3.2.2]nonan-4-ylcarbonyl)chromen-4-one; methanoic acid Openeye Name: 3-(1,4-diazabicyclo[3.2.2]nonane-4-carbonyl)chromen-4-one; formic acid CAS Name: 3-[1,4-diazabicyclo[3.2.2]nonan-4-yl(oxo)methyl]-1-benzopyran-4-one; formic acid IUPAC Name: 3-(1,4-diazabicyclo[3.2.2]nonane-4-carbonyl)chromen-4-one; formic acid Traditional Name: 3-(1,4-diazabicyclo[3.2.2]nonane-4-carbonyl)chromone; formic acid Formula: C18H20N2O5 MolecularWeight: 344.3618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1N(CC2)C(=O)C3=COC4=CC=CC=C4C3=O.C(=O)O

Isomeric SMILES

C1CN2CCC1N(CC2)C(=O)C3=COC4=CC=CC=C4C3=O.C(=O)O

InChI

InChI=1S/C17H18N2O3.CH2O2/c20-16-13-3-1-2-4-15(13)22-11-14(16)17(21)19-10-9-18-7-5-12(19)6-8-18;2-1-3/h1-4,11-12H,5-10H2;1H,(H,2,3)