methyl 9-chloranyl-7-(2-fluorophenyl)-2-oxidanylidene-5H-pyrano[3,2-d][2]benzazepine-3-carboxylate

Systemtic Name: methyl 9-chloranyl-7-(2-fluorophenyl)-2-oxidanylidene-5H-pyrano[3,2-d][2]benzazepine-3-carboxylate Openeye Name: methyl 9-chloro-7-(2-fluorophenyl)-2-oxo-5H-pyrano[3,2-d][2]benzazepine-3-carboxylate CAS Name: 9-chloro-7-(2-fluorophenyl)-2-oxo-5H-pyrano[3,2-d][2]benzazepine-3-carboxylic acid methyl ester IUPAC Name: methyl 9-chloro-7-(2-fluorophenyl)-2-oxo-5H-pyrano[3,2-d][2]benzazepine-3-carboxylate Traditional Name: 9-chloro-7-(2-fluorophenyl)-2-keto-5H-pyrano[3,2-d][2]benzazepine-3-carboxylic acid methyl ester Formula: C21H13ClFNO4 MolecularWeight: 397.783623

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4F)OC1=O

Isomeric SMILES

COC(=O)C1=CC2=C(C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4F)OC1=O

InChI

InChI=1S/C21H13ClFNO4/c1-27-20(25)16-8-11-10-24-18(14-4-2-3-5-17(14)23)15-9-12(22)6-7-13(15)19(11)28-21(16)26/h2-9H,10H2,1H3