methyl 7-chloranyl-3-oxidanylidene-1,5-benzoxathiepine-4-carboxylate

Systemtic Name: methyl 7-chloranyl-3-oxidanylidene-1,5-benzoxathiepine-4-carboxylate Openeye Name: methyl 7-chloro-3-oxo-1,5-benzoxathiepine-4-carboxylate CAS Name: 7-chloro-3-oxo-1,5-benzoxathiepin-4-carboxylic acid methyl ester IUPAC Name: methyl 7-chloro-3-oxo-1,5-benzoxathiepine-4-carboxylate Traditional Name: 7-chloro-3-keto-1,5-benzoxathiepin-4-carboxylic acid methyl ester Formula: C11H9ClO4S MolecularWeight: 272.70476

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=O)COC2=C(S1)C=C(C=C2)Cl

Isomeric SMILES

COC(=O)C1C(=O)COC2=C(S1)C=C(C=C2)Cl

InChI

InChI=1S/C11H9ClO4S/c1-15-11(14)10-7(13)5-16-8-3-2-6(12)4-9(8)17-10/h2-4,10H,5H2,1H3