1-[2,3-bis(chloranyl)-4-methoxy-phenyl]propan-1-one; cyclopentylmethanol

Systemtic Name: 1-[2,3-bis(chloranyl)-4-methoxy-phenyl]propan-1-one; cyclopentylmethanol Openeye Name: cyclopentylmethanol; 1-(2,3-dichloro-4-methoxy-phenyl)propan-1-one CAS Name: cyclopentylmethanol; 1-(2,3-dichloro-4-methoxyphenyl)-1-propanone IUPAC Name: cyclopentylmethanol; 1-(2,3-dichloro-4-methoxyphenyl)propan-1-one Traditional Name: cyclopentylmethanol; 1-(2,3-dichloro-4-methoxy-phenyl)propan-1-one Formula: C16H22Cl2O3 MolecularWeight: 333.25008

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=C(C(=C(C=C1)OC)Cl)Cl.C1CCC(C1)CO

Isomeric SMILES

CCC(=O)C1=C(C(=C(C=C1)OC)Cl)Cl.C1CCC(C1)CO

InChI

InChI=1S/C10H10Cl2O2.C6H12O/c1-3-7(13)6-4-5-8(14-2)10(12)9(6)11;7-5-6-3-1-2-4-6/h4-5H,3H2,1-2H3;6-7H,1-5H2