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1-(bromomethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine

1-(bromomethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name:1-(bromomethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine
Openeye Name:1-(bromomethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine
CAS Name:1-(bromomethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepin
IUPAC Name:1-(bromomethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine
Traditional Name:1-(bromomethyl)-4-cyclopentyl-8,9-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepin
Formula: C18H25BrO2S
MolecularWeight: 385.3589
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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(CC(CSC2CBr)C3CCCC3)C=C1)OC


Isomeric SMILES

COC1=C(C2=C(CC(CSC2CBr)C3CCCC3)C=C1)OC


InChI

InChI=1S/C18H25BrO2S/c1-20-15-8-7-13-9-14(12-5-3-4-6-12)11-22-16(10-19)17(13)18(15)21-2/h7-8,12,14,16H,3-6,9-11H2,1-2H3


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