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

Systemtic Name: 1-[4-(2-chloroethyloxy)-2-oxidanyl-3-propyl-phenyl]ethanone Openeye Name: 1-[4-(2-chloroethoxy)-2-hydroxy-3-propyl-phenyl]ethanone CAS Name: 1-[4-(2-chloroethoxy)-2-hydroxy-3-propylphenyl]ethanone IUPAC Name: 1-[4-(2-chloroethoxy)-2-hydroxy-3-propylphenyl]ethanone Traditional Name: 1-[4-(2-chloroethoxy)-2-hydroxy-3-propyl-phenyl]ethanone Formula: C13H17ClO3 MolecularWeight: 256.72528

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCl

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCl

InChI

InChI=1S/C13H17ClO3/c1-3-4-11-12(17-8-7-14)6-5-10(9(2)15)13(11)16/h5-6,16H,3-4,7-8H2,1-2H3