1-(4-chloranyl-2-methyl-phenoxy)pentan-3-one

Systemtic Name: 1-(4-chloranyl-2-methyl-phenoxy)pentan-3-one Openeye Name: 1-(4-chloro-2-methyl-phenoxy)pentan-3-one CAS Name: 1-(4-chloro-2-methylphenoxy)-3-pentanone IUPAC Name: 1-(4-chloro-2-methylphenoxy)pentan-3-one Traditional Name: 1-(4-chloro-2-methyl-phenoxy)pentan-3-one Formula: C12H15ClO2 MolecularWeight: 226.6993

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CCOC1=C(C=C(C=C1)Cl)C

Isomeric SMILES

CCC(=O)CCOC1=C(C=C(C=C1)Cl)C

InChI

InChI=1S/C12H15ClO2/c1-3-11(14)6-7-15-12-5-4-10(13)8-9(12)2/h4-5,8H,3,6-7H2,1-2H3