4-chloranyl-3-methyl-3-oxidanyl-1-phenyl-butan-1-one

Systemtic Name: 4-chloranyl-3-methyl-3-oxidanyl-1-phenyl-butan-1-one Openeye Name: 4-chloro-3-hydroxy-3-methyl-1-phenyl-butan-1-one CAS Name: 4-chloro-3-hydroxy-3-methyl-1-phenyl-1-butanone IUPAC Name: 4-chloro-3-hydroxy-3-methyl-1-phenylbutan-1-one Traditional Name: 4-chloro-3-hydroxy-3-methyl-1-phenyl-butan-1-one Formula: C11H13ClO2 MolecularWeight: 212.67272

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=CC=C1)(CCl)O

Isomeric SMILES

CC(CC(=O)C1=CC=CC=C1)(CCl)O

InChI

InChI=1S/C11H13ClO2/c1-11(14,8-12)7-10(13)9-5-3-2-4-6-9/h2-6,14H,7-8H2,1H3