1-(bromomethyl)-8,9-bis(chloranyl)-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 1-(bromomethyl)-8,9-bis(chloranyl)-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 1-(bromomethyl)-8,9-dichloro-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 1-(bromomethyl)-8,9-dichloro-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 1-(bromomethyl)-8,9-dichloro-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 1-(bromomethyl)-8,9-dichloro-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepin Formula: C12H13BrCl2OS MolecularWeight: 356.10602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(SCCCC2=C1)CBr)Cl)Cl

Isomeric SMILES

COC1=C(C(=C2C(SCCCC2=C1)CBr)Cl)Cl

InChI

InChI=1S/C12H13BrCl2OS/c1-16-8-5-7-3-2-4-17-9(6-13)10(7)12(15)11(8)14/h5,9H,2-4,6H2,1H3