methyl 7-chloranyl-5-oxidanylidene-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylate

Systemtic Name: methyl 7-chloranyl-5-oxidanylidene-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylate Openeye Name: methyl 7-chloro-5-oxo-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylate CAS Name: 7-chloro-5-oxo-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylic acid methyl ester IUPAC Name: methyl 7-chloro-5-oxo-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylate Traditional Name: 7-chloro-5-keto-4H-thieno[2,3-b][1,4]benzoxazepine-2-carboxylic acid methyl ester Formula: C13H8ClNO4S MolecularWeight: 309.72492

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(S1)OC3=C(C=C(C=C3)Cl)C(=O)N2

Isomeric SMILES

COC(=O)C1=CC2=C(S1)OC3=C(C=C(C=C3)Cl)C(=O)N2

InChI

InChI=1S/C13H8ClNO4S/c1-18-12(17)10-5-8-13(20-10)19-9-3-2-6(14)4-7(9)11(16)15-8/h2-5H,1H3,(H,15,16)