1-[2-(3-chloranylphenoxy)-4-(phenylmethyl)piperazin-1-yl]-2-methyl-butan-1-one

Systemtic Name: 1-[2-(3-chloranylphenoxy)-4-(phenylmethyl)piperazin-1-yl]-2-methyl-butan-1-one Openeye Name: 1-[4-benzyl-2-(3-chlorophenoxy)piperazin-1-yl]-2-methyl-butan-1-one CAS Name: 1-[2-(3-chlorophenoxy)-4-(phenylmethyl)-1-piperazinyl]-2-methyl-1-butanone IUPAC Name: 1-[4-benzyl-2-(3-chlorophenoxy)piperazin-1-yl]-2-methylbutan-1-one Traditional Name: 1-[4-benzyl-2-(3-chlorophenoxy)piperazino]-2-methyl-butan-1-one Formula: C22H27ClN2O2 MolecularWeight: 386.91498

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)N1CCN(CC1OC2=CC(=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(=O)N1CCN(CC1OC2=CC(=CC=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C22H27ClN2O2/c1-3-17(2)22(26)25-13-12-24(15-18-8-5-4-6-9-18)16-21(25)27-20-11-7-10-19(23)14-20/h4-11,14,17,21H,3,12-13,15-16H2,1-2H3