1-[3-(3-chloranyl-2-oxidanyl-propyl)-4-oxidanyl-phenyl]-2-oxidanyl-ethanone

Systemtic Name: 1-[3-(3-chloranyl-2-oxidanyl-propyl)-4-oxidanyl-phenyl]-2-oxidanyl-ethanone Openeye Name: 1-[3-(3-chloro-2-hydroxy-propyl)-4-hydroxy-phenyl]-2-hydroxy-ethanone CAS Name: 1-[3-(3-chloro-2-hydroxypropyl)-4-hydroxyphenyl]-2-hydroxyethanone IUPAC Name: 1-[3-(3-chloro-2-hydroxypropyl)-4-hydroxyphenyl]-2-hydroxyethanone Traditional Name: 1-[3-(3-chloro-2-hydroxy-propyl)-4-hydroxy-phenyl]-2-hydroxy-ethanone Formula: C11H13ClO4 MolecularWeight: 244.67152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)CO)CC(CCl)O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)CO)CC(CCl)O)O

InChI

InChI=1S/C11H13ClO4/c12-5-9(14)4-8-3-7(11(16)6-13)1-2-10(8)15/h1-3,9,13-15H,4-6H2