5-chloranyl-1,1-dimethoxy-4-oxidanyl-4-phenyl-pentan-2-one

Systemtic Name: 5-chloranyl-1,1-dimethoxy-4-oxidanyl-4-phenyl-pentan-2-one Openeye Name: 5-chloro-4-hydroxy-1,1-dimethoxy-4-phenyl-pentan-2-one CAS Name: 5-chloro-4-hydroxy-1,1-dimethoxy-4-phenyl-2-pentanone IUPAC Name: 5-chloro-4-hydroxy-1,1-dimethoxy-4-phenylpentan-2-one Traditional Name: 5-chloro-4-hydroxy-1,1-dimethoxy-4-phenyl-pentan-2-one Formula: C13H17ClO4 MolecularWeight: 272.72468

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Descriptors Computed from Structure

Canonical SMILES:

COC(C(=O)CC(CCl)(C1=CC=CC=C1)O)OC

Isomeric SMILES

COC(C(=O)CC(CCl)(C1=CC=CC=C1)O)OC

InChI

InChI=1S/C13H17ClO4/c1-17-12(18-2)11(15)8-13(16,9-14)10-6-4-3-5-7-10/h3-7,12,16H,8-9H2,1-2H3