4-[[5-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-1,2-oxazol-3-yl]carbonyl]-1-cyclopentyl-piperazin-2-one

Systemtic Name: 4-[[5-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-1,2-oxazol-3-yl]carbonyl]-1-cyclopentyl-piperazin-2-one Openeye Name: 4-[5-[(4-chloro-3,5-dimethyl-phenoxy)methyl]isoxazole-3-carbonyl]-1-cyclopentyl-piperazin-2-one CAS Name: 4-[[5-[(4-chloro-3,5-dimethylphenoxy)methyl]-3-isoxazolyl]-oxomethyl]-1-cyclopentyl-2-piperazinone IUPAC Name: 4-[5-[(4-chloro-3,5-dimethylphenoxy)methyl]-1,2-oxazole-3-carbonyl]-1-cyclopentylpiperazin-2-one Traditional Name: 4-[5-[(4-chloro-3,5-dimethyl-phenoxy)methyl]isoxazole-3-carbonyl]-1-cyclopentyl-piperazin-2-one Formula: C22H26ClN3O4 MolecularWeight: 431.91254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCC2=CC(=NO2)C(=O)N3CCN(C(=O)C3)C4CCCC4

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCC2=CC(=NO2)C(=O)N3CCN(C(=O)C3)C4CCCC4

InChI

InChI=1S/C22H26ClN3O4/c1-14-9-17(10-15(2)21(14)23)29-13-18-11-19(24-30-18)22(28)25-7-8-26(20(27)12-25)16-5-3-4-6-16/h9-11,16H,3-8,12-13H2,1-2H3