ethyl 2-(5-chloranyl-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-(5-chloranyl-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-(5-chloro-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-2-oxo-acetate CAS Name: 2-(5-chloro-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-(5-chloro-4,5,6,7-tetrahydro-2-benzothiophen-1-yl)-2-oxoacetate Traditional Name: 2-(5-chloro-4,5,6,7-tetrahydroisobenzothiophen-1-yl)-2-keto-acetic acid ethyl ester Formula: C12H13ClO3S MolecularWeight: 272.74782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C1=C2CCC(CC2=CS1)Cl

Isomeric SMILES

CCOC(=O)C(=O)C1=C2CCC(CC2=CS1)Cl

InChI

InChI=1S/C12H13ClO3S/c1-2-16-12(15)10(14)11-9-4-3-8(13)5-7(9)6-17-11/h6,8H,2-5H2,1H3