1-(6-bromanyl-5-methyl-hexan-2-yl)-6,7-dimethoxy-3,4-dihydro-1H-isothiochromene

Systemtic Name: 1-(6-bromanyl-5-methyl-hexan-2-yl)-6,7-dimethoxy-3,4-dihydro-1H-isothiochromene Openeye Name: 1-(5-bromo-1,4-dimethyl-pentyl)-6,7-dimethoxy-isothiochromane CAS Name: 1-(6-bromo-5-methylhexan-2-yl)-6,7-dimethoxy-3,4-dihydro-1H-2-benzothiopyran IUPAC Name: 1-(6-bromo-5-methylhexan-2-yl)-6,7-dimethoxy-3,4-dihydro-1H-isothiochromene Traditional Name: 1-(5-bromo-1,4-dimethyl-pentyl)-6,7-dimethoxy-isothiochroman Formula: C18H27BrO2S MolecularWeight: 387.37478

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C)C1C2=CC(=C(C=C2CCS1)OC)OC)CBr

Isomeric SMILES

CC(CCC(C)C1C2=CC(=C(C=C2CCS1)OC)OC)CBr

InChI

InChI=1S/C18H27BrO2S/c1-12(11-19)5-6-13(2)18-15-10-17(21-4)16(20-3)9-14(15)7-8-22-18/h9-10,12-13,18H,5-8,11H2,1-4H3