1-(bromomethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 1-(bromomethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 1-(bromomethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 1-(bromomethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 1-(bromomethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 1-(bromomethyl)-9-methoxy-4-phenyl-1,3,4,5-tetrahydro-2-benzothiepin Formula: C18H19BrOS MolecularWeight: 363.31186

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1C(SCC(C2)C3=CC=CC=C3)CBr

Isomeric SMILES

COC1=CC=CC2=C1C(SCC(C2)C3=CC=CC=C3)CBr

InChI

InChI=1S/C18H19BrOS/c1-20-16-9-5-8-14-10-15(13-6-3-2-4-7-13)12-21-17(11-19)18(14)16/h2-9,15,17H,10-12H2,1H3