1-(3-bromanyl-5-methyl-2-oxidanyl-phenyl)dodecan-1-one

Systemtic Name: 1-(3-bromanyl-5-methyl-2-oxidanyl-phenyl)dodecan-1-one Openeye Name: 1-(3-bromo-2-hydroxy-5-methyl-phenyl)dodecan-1-one CAS Name: 1-(3-bromo-2-hydroxy-5-methylphenyl)-1-dodecanone IUPAC Name: 1-(3-bromo-2-hydroxy-5-methylphenyl)dodecan-1-one Traditional Name: 1-(3-bromo-2-hydroxy-5-methyl-phenyl)dodecan-1-one Formula: C19H29BrO2 MolecularWeight: 369.33636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C1=CC(=CC(=C1O)Br)C

Isomeric SMILES

CCCCCCCCCCCC(=O)C1=CC(=CC(=C1O)Br)C

InChI

InChI=1S/C19H29BrO2/c1-3-4-5-6-7-8-9-10-11-12-18(21)16-13-15(2)14-17(20)19(16)22/h13-14,22H,3-12H2,1-2H3