7-bromanyl-2-methyl-2-(4-methyl-4-oxidanyl-pentyl)-6-oxidanyl-3H-chromen-4-one

Systemtic Name: 7-bromanyl-2-methyl-2-(4-methyl-4-oxidanyl-pentyl)-6-oxidanyl-3H-chromen-4-one Openeye Name: 7-bromo-6-hydroxy-2-(4-hydroxy-4-methyl-pentyl)-2-methyl-chroman-4-one CAS Name: 7-bromo-6-hydroxy-2-(4-hydroxy-4-methylpentyl)-2-methyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 7-bromo-6-hydroxy-2-(4-hydroxy-4-methylpentyl)-2-methyl-3H-chromen-4-one Traditional Name: 7-bromo-6-hydroxy-2-(4-hydroxy-4-methyl-pentyl)-2-methyl-chroman-4-one Formula: C16H21BrO4 MolecularWeight: 357.23954

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2=CC(=C(C=C2O1)Br)O)CCCC(C)(C)O

Isomeric SMILES

CC1(CC(=O)C2=CC(=C(C=C2O1)Br)O)CCCC(C)(C)O

InChI

InChI=1S/C16H21BrO4/c1-15(2,20)5-4-6-16(3)9-13(19)10-7-12(18)11(17)8-14(10)21-16/h7-8,18,20H,4-6,9H2,1-3H3