8-bromanyl-5-methoxy-4,7-bis(oxidanylidene)-6-propoxy-1H-cyclohepta[b]pyridine-2-carboxylic acid

Systemtic Name: 8-bromanyl-5-methoxy-4,7-bis(oxidanylidene)-6-propoxy-1H-cyclohepta[b]pyridine-2-carboxylic acid Openeye Name: 8-bromo-5-methoxy-4,7-dioxo-6-propoxy-1H-cyclohepta[b]pyridine-2-carboxylic acid CAS Name: 8-bromo-5-methoxy-4,7-dioxo-6-propoxy-1H-cyclohepta[b]pyridine-2-carboxylic acid IUPAC Name: 8-bromo-5-methoxy-4,7-dioxo-6-propoxy-1H-cyclohepta[b]pyridine-2-carboxylic acid Traditional Name: 8-bromo-4,7-diketo-5-methoxy-6-propoxy-1H-cyclohepta[b]pyridine-2-carboxylic acid Formula: C15H14BrNO6 MolecularWeight: 384.17876

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C2=C(C=C(C1=O)Br)NC(=CC2=O)C(=O)O)OC

Isomeric SMILES

CCCOC1=C(C2=C(C=C(C1=O)Br)NC(=CC2=O)C(=O)O)OC

InChI

InChI=1S/C15H14BrNO6/c1-3-4-23-14-12(19)7(16)5-8-11(13(14)22-2)10(18)6-9(17-8)15(20)21/h5-6H,3-4H2,1-2H3,(H,17,18)(H,20,21)