7-bromanyl-1-(2-chloroethyl)-6-methoxy-1H-isothiochromene

Systemtic Name: 7-bromanyl-1-(2-chloroethyl)-6-methoxy-1H-isothiochromene Openeye Name: 7-bromo-1-(2-chloroethyl)-6-methoxy-1H-isothiochromene CAS Name: 7-bromo-1-(2-chloroethyl)-6-methoxy-1H-2-benzothiopyran IUPAC Name: 7-bromo-1-(2-chloroethyl)-6-methoxy-1H-isothiochromene Traditional Name: 7-bromo-1-(2-chloroethyl)-6-methoxy-1H-isothiochromene Formula: C12H12BrClOS MolecularWeight: 319.64508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(SC=CC2=C1)CCCl)Br

Isomeric SMILES

COC1=C(C=C2C(SC=CC2=C1)CCCl)Br

InChI

InChI=1S/C12H12BrClOS/c1-15-11-6-8-3-5-16-12(2-4-14)9(8)7-10(11)13/h3,5-7,12H,2,4H2,1H3