1-[4-[4-[4-(4-chloranylphenoxy)-3-oxidanyl-butyl]piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[4-(4-chloranylphenoxy)-3-oxidanyl-butyl]piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[4-(4-chlorophenoxy)-3-hydroxy-butyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[4-(4-chlorophenoxy)-3-hydroxybutyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[4-(4-chlorophenoxy)-3-hydroxybutyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[4-(4-chlorophenoxy)-3-hydroxy-butyl]piperazino]phenyl]ethanone Formula: C22H27ClN2O3 MolecularWeight: 402.91438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CCC(COC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)CCC(COC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C22H27ClN2O3/c1-17(26)18-2-6-20(7-3-18)25-14-12-24(13-15-25)11-10-21(27)16-28-22-8-4-19(23)5-9-22/h2-9,21,27H,10-16H2,1H3