1-(5-bromanyl-2,2-dimethyl-pentyl)-6,7-dimethoxy-1-methyl-3,4-dihydroisothiochromene

Systemtic Name: 1-(5-bromanyl-2,2-dimethyl-pentyl)-6,7-dimethoxy-1-methyl-3,4-dihydroisothiochromene Openeye Name: 1-(5-bromo-2,2-dimethyl-pentyl)-6,7-dimethoxy-1-methyl-isothiochromane CAS Name: 1-(5-bromo-2,2-dimethylpentyl)-6,7-dimethoxy-1-methyl-3,4-dihydro-2-benzothiopyran IUPAC Name: 1-(5-bromo-2,2-dimethylpentyl)-6,7-dimethoxy-1-methyl-3,4-dihydroisothiochromene Traditional Name: 1-(5-bromo-2,2-dimethyl-pentyl)-6,7-dimethoxy-1-methyl-isothiochroman Formula: C19H29BrO2S MolecularWeight: 401.40136

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=C(C=C2CCS1)OC)OC)CC(C)(C)CCCBr

Isomeric SMILES

CC1(C2=CC(=C(C=C2CCS1)OC)OC)CC(C)(C)CCCBr

InChI

InChI=1S/C19H29BrO2S/c1-18(2,8-6-9-20)13-19(3)15-12-17(22-5)16(21-4)11-14(15)7-10-23-19/h11-12H,6-10,13H2,1-5H3