4-[3-(3-chlorophenyl)-3-(2-hydroxyphenyl)propanoyl]-3,3-dimethyl-piperazin-2-one

Systemtic Name: 4-[3-(3-chlorophenyl)-3-(2-hydroxyphenyl)propanoyl]-3,3-dimethyl-piperazin-2-one Openeye Name: 4-[3-(3-chlorophenyl)-3-(2-hydroxyphenyl)propanoyl]-3,3-dimethyl-piperazin-2-one CAS Name: 4-[3-(3-chlorophenyl)-3-(2-hydroxyphenyl)-1-oxopropyl]-3,3-dimethyl-2-piperazinone IUPAC Name: 4-[3-(3-chlorophenyl)-3-(2-hydroxyphenyl)propanoyl]-3,3-dimethylpiperazin-2-one Traditional Name: 4-[3-(3-chlorophenyl)-3-(2-hydroxyphenyl)propanoyl]-3,3-dimethyl-piperazin-2-one Formula: C21H23ClN2O3 MolecularWeight: 386.87192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)NCCN1C(=O)CC(C2=CC(=CC=C2)Cl)C3=CC=CC=C3O)C

Isomeric SMILES

CC1(C(=O)NCCN1C(=O)CC(C2=CC(=CC=C2)Cl)C3=CC=CC=C3O)C

InChI

InChI=1S/C21H23ClN2O3/c1-21(2)20(27)23-10-11-24(21)19(26)13-17(14-6-5-7-15(22)12-14)16-8-3-4-9-18(16)25/h3-9,12,17,25H,10-11,13H2,1-2H3,(H,23,27)