(3R)-6,8-bis(bromanyl)-3-(hydroxymethyl)-3-(4-methylphenyl)sulfanyl-2H-chromen-4-one

Systemtic Name: (3R)-6,8-bis(bromanyl)-3-(hydroxymethyl)-3-(4-methylphenyl)sulfanyl-2H-chromen-4-one Openeye Name: (3R)-6,8-dibromo-3-(hydroxymethyl)-3-(p-tolylsulfanyl)chroman-4-one CAS Name: (3R)-6,8-dibromo-3-(hydroxymethyl)-3-[(4-methylphenyl)thio]-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: (3R)-6,8-dibromo-3-(hydroxymethyl)-3-(4-methylphenyl)sulfanyl-2H-chromen-4-one Traditional Name: (3R)-6,8-dibromo-3-methylol-3-(p-tolylthio)chroman-4-one Formula: C17H14Br2O3S MolecularWeight: 458.16426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2(COC3=C(C=C(C=C3C2=O)Br)Br)CO

Isomeric SMILES

CC1=CC=C(C=C1)S[C@@]2(COC3=C(C=C(C=C3C2=O)Br)Br)CO

InChI

InChI=1S/C17H14Br2O3S/c1-10-2-4-12(5-3-10)23-17(8-20)9-22-15-13(16(17)21)6-11(18)7-14(15)19/h2-7,20H,8-9H2,1H3/t17-/m1/s1