5-chloranyl-8-oxidanyl-1-phenyl-pentadecane-1,3-dione

Systemtic Name: 5-chloranyl-8-oxidanyl-1-phenyl-pentadecane-1,3-dione Openeye Name: 5-chloro-8-hydroxy-1-phenyl-pentadecane-1,3-dione CAS Name: 5-chloro-8-hydroxy-1-phenylpentadecane-1,3-dione IUPAC Name: 5-chloro-8-hydroxy-1-phenylpentadecane-1,3-dione Traditional Name: 5-chloro-8-hydroxy-1-phenyl-pentadecane-1,3-dione Formula: C21H31ClO3 MolecularWeight: 366.92204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCC(CC(=O)CC(=O)C1=CC=CC=C1)Cl)O

Isomeric SMILES

CCCCCCCC(CCC(CC(=O)CC(=O)C1=CC=CC=C1)Cl)O

InChI

InChI=1S/C21H31ClO3/c1-2-3-4-5-9-12-19(23)14-13-18(22)15-20(24)16-21(25)17-10-7-6-8-11-17/h6-8,10-11,18-19,23H,2-5,9,12-16H2,1H3