(2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-2-ethyl-hexan-1-one

Systemtic Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-2-ethyl-hexan-1-one Openeye Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-2-ethyl-hexan-1-one CAS Name: (2S)-1-[4-(3-chlorophenyl)-1-piperazinyl]-2-ethyl-1-hexanone IUPAC Name: (2S)-1-[4-(3-chlorophenyl)piperazin-1-yl]-2-ethylhexan-1-one Traditional Name: (2S)-1-[4-(3-chlorophenyl)piperazino]-2-ethyl-hexan-1-one Formula: C18H27ClN2O MolecularWeight: 322.87278

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCCC[C@H](CC)C(=O)N1CCN(CC1)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C18H27ClN2O/c1-3-5-7-15(4-2)18(22)21-12-10-20(11-13-21)17-9-6-8-16(19)14-17/h6,8-9,14-15H,3-5,7,10-13H2,1-2H3/t15-/m0/s1