methyl 5,7-bis(chloranyl)thieno[2,3-b][1,4]benzoxazepine-2-carboxylate

Systemtic Name: methyl 5,7-bis(chloranyl)thieno[2,3-b][1,4]benzoxazepine-2-carboxylate Openeye Name: methyl 5,7-dichlorothieno[2,3-b][1,4]benzoxazepine-2-carboxylate CAS Name: 5,7-dichloro-2-thieno[2,3-b][1,4]benzoxazepinecarboxylic acid methyl ester IUPAC Name: methyl 5,7-dichlorothieno[2,3-b][1,4]benzoxazepine-2-carboxylate Traditional Name: 5,7-dichlorothieno[2,3-b][1,4]benzoxazepine-2-carboxylic acid methyl ester Formula: C13H7Cl2NO3S MolecularWeight: 328.17058

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7Cl2NO3S/c1-18-12(17)10-5-8-13(20-10)19-9-3-2-6(14)4-7(9)11(15)16-8/h2-5H,1H3