6-ethoxy-1-ethyl-4,7-bis(oxidanylidene)-5-phenoxy-cyclohepta[b]pyridine-2-carboxylic acid

Systemtic Name: 6-ethoxy-1-ethyl-4,7-bis(oxidanylidene)-5-phenoxy-cyclohepta[b]pyridine-2-carboxylic acid Openeye Name: 6-ethoxy-1-ethyl-4,7-dioxo-5-phenoxy-cyclohepta[b]pyridine-2-carboxylic acid CAS Name: 6-ethoxy-1-ethyl-4,7-dioxo-5-phenoxy-2-cyclohepta[b]pyridinecarboxylic acid IUPAC Name: 6-ethoxy-1-ethyl-4,7-dioxo-5-phenoxycyclohepta[b]pyridine-2-carboxylic acid Traditional Name: 6-ethoxy-1-ethyl-4,7-diketo-5-phenoxy-cyclohepta[b]pyridine-2-carboxylic acid Formula: C21H19NO6 MolecularWeight: 381.37866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=O)C=C1C(=O)O)C(=C(C(=O)C=C2)OCC)OC3=CC=CC=C3

Isomeric SMILES

CCN1C2=C(C(=O)C=C1C(=O)O)C(=C(C(=O)C=C2)OCC)OC3=CC=CC=C3

InChI

InChI=1S/C21H19NO6/c1-3-22-14-10-11-16(23)19(27-4-2)20(28-13-8-6-5-7-9-13)18(14)17(24)12-15(22)21(25)26/h5-12H,3-4H2,1-2H3,(H,25,26)