1-[3-chloranyl-2-methoxy-4,6-bis(oxidanyl)phenyl]hexan-1-one

Systemtic Name: 1-[3-chloranyl-2-methoxy-4,6-bis(oxidanyl)phenyl]hexan-1-one Openeye Name: 1-(3-chloro-4,6-dihydroxy-2-methoxy-phenyl)hexan-1-one CAS Name: 1-(3-chloro-4,6-dihydroxy-2-methoxyphenyl)-1-hexanone IUPAC Name: 1-(3-chloro-4,6-dihydroxy-2-methoxyphenyl)hexan-1-one Traditional Name: 1-(3-chloro-4,6-dihydroxy-2-methoxy-phenyl)hexan-1-one Formula: C13H17ClO4 MolecularWeight: 272.72468

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=C(C(=C(C=C1O)O)Cl)OC

Isomeric SMILES

CCCCCC(=O)C1=C(C(=C(C=C1O)O)Cl)OC

InChI

InChI=1S/C13H17ClO4/c1-3-4-5-6-8(15)11-9(16)7-10(17)12(14)13(11)18-2/h7,16-17H,3-6H2,1-2H3