ethyl 6-bromanyl-2H-thiochromene-3-carboxylate

Systemtic Name: ethyl 6-bromanyl-2H-thiochromene-3-carboxylate Openeye Name: ethyl 6-bromo-2H-thiochromene-3-carboxylate CAS Name: 6-bromo-2H-1-benzothiopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-bromo-2H-thiochromene-3-carboxylate Traditional Name: 6-bromo-2H-thiochromene-3-carboxylic acid ethyl ester Formula: C12H11BrO2S MolecularWeight: 299.18354

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=CC(=C2)Br)SC1

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=CC(=C2)Br)SC1

InChI

InChI=1S/C12H11BrO2S/c1-2-15-12(14)9-5-8-6-10(13)3-4-11(8)16-7-9/h3-6H,2,7H2,1H3