8-bromanyl-1-(bromomethyl)-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 8-bromanyl-1-(bromomethyl)-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 8-bromo-1-(bromomethyl)-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 8-bromo-1-(bromomethyl)-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 8-bromo-1-(bromomethyl)-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 8-bromo-1-(bromomethyl)-7-methoxy-1,3,4,5-tetrahydro-2-benzothiepin Formula: C12H14Br2OS MolecularWeight: 366.11196

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14Br2OS/c1-15-11-5-8-3-2-4-16-12(7-13)9(8)6-10(11)14/h5-6,12H,2-4,7H2,1H3