4-[[5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]carbonyl]piperazin-2-one

Systemtic Name: 4-[[5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]carbonyl]piperazin-2-one Openeye Name: 4-[5-[(2,6-dimethylphenoxy)methyl]isoxazole-3-carbonyl]piperazin-2-one CAS Name: 4-[[5-[(2,6-dimethylphenoxy)methyl]-3-isoxazolyl]-oxomethyl]-2-piperazinone IUPAC Name: 4-[5-[(2,6-dimethylphenoxy)methyl]-1,2-oxazole-3-carbonyl]piperazin-2-one Traditional Name: 4-[5-[(2,6-dimethylphenoxy)methyl]isoxazole-3-carbonyl]piperazin-2-one Formula: C17H19N3O4 MolecularWeight: 329.35046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCC2=CC(=NO2)C(=O)N3CCNC(=O)C3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCC2=CC(=NO2)C(=O)N3CCNC(=O)C3

InChI

InChI=1S/C17H19N3O4/c1-11-4-3-5-12(2)16(11)23-10-13-8-14(19-24-13)17(22)20-7-6-18-15(21)9-20/h3-5,8H,6-7,9-10H2,1-2H3,(H,18,21)