1-(6-bromanyl-5-methyl-hexan-2-yl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine

Systemtic Name: 1-(6-bromanyl-5-methyl-hexan-2-yl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine Openeye Name: 1-(5-bromo-1,4-dimethyl-pentyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine CAS Name: 1-(6-bromo-5-methylhexan-2-yl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepin IUPAC Name: 1-(6-bromo-5-methylhexan-2-yl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepine Traditional Name: 1-(5-bromo-1,4-dimethyl-pentyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2-benzothiepin Formula: C19H29BrO2S MolecularWeight: 401.40136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C)C1C2=CC(=C(C=C2CCCS1)OC)OC)CBr

Isomeric SMILES

CC(CCC(C)C1C2=CC(=C(C=C2CCCS1)OC)OC)CBr

InChI

InChI=1S/C19H29BrO2S/c1-13(12-20)7-8-14(2)19-16-11-18(22-4)17(21-3)10-15(16)6-5-9-23-19/h10-11,13-14,19H,5-9,12H2,1-4H3