5-methoxy-4-oxidanylidene-3-(1H-pyridin-4-ylidene)cyclohexa-1,5-diene-1-carboxylate

Systemtic Name: 5-methoxy-4-oxidanylidene-3-(1H-pyridin-4-ylidene)cyclohexa-1,5-diene-1-carboxylate Openeye Name: 5-methoxy-4-oxo-3-(1H-pyridin-4-ylidene)cyclohexa-1,5-diene-1-carboxylate CAS Name: 5-methoxy-4-oxo-3-(1H-pyridin-4-ylidene)-1-cyclohexa-1,5-dienecarboxylate IUPAC Name: 5-methoxy-4-oxo-3-(1H-pyridin-4-ylidene)cyclohexa-1,5-diene-1-carboxylate Traditional Name: 4-keto-5-methoxy-3-(1H-pyridin-4-ylidene)cyclohexa-1,5-diene-1-carboxylate Formula: C13H10NO4- MolecularWeight: 244.2228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C2C=CNC=C2)C1=O)C(=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C2C=CNC=C2)C1=O)C(=O)[O-]

InChI

InChI=1S/C13H11NO4/c1-18-11-7-9(13(16)17)6-10(12(11)15)8-2-4-14-5-3-8/h2-7,14H,1H3,(H,16,17)/p-1