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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(CC(COC2=CC=C(C=C2)Cl)O)N3CCNCC3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(CC(COC2=CC=C(C=C2)Cl)O)N3CCNCC3

InChI

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