4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)carbonyl-2-ethyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-6-(3,5-dimethylpyrazol-1-yl)carbonyl-2-ethyl-1,4-benzoxazin-3-one Openeye Name: 4-[(2-chloro-6-fluoro-phenyl)methyl]-6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-1,4-benzoxazin-3-one CAS Name: 4-[(2-chloro-6-fluorophenyl)methyl]-6-[(3,5-dimethyl-1-pyrazolyl)-oxomethyl]-2-ethyl-1,4-benzoxazin-3-one IUPAC Name: 4-[(2-chloro-6-fluorophenyl)methyl]-6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-1,4-benzoxazin-3-one Traditional Name: 4-(2-chloro-6-fluoro-benzyl)-6-(3,5-dimethylpyrazole-1-carbonyl)-2-ethyl-1,4-benzoxazin-3-one Formula: C23H21ClFN3O3 MolecularWeight: 441.882543

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3C(=CC(=N3)C)C)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CCC1C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3C(=CC(=N3)C)C)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C23H21ClFN3O3/c1-4-20-23(30)27(12-16-17(24)6-5-7-18(16)25)19-11-15(8-9-21(19)31-20)22(29)28-14(3)10-13(2)26-28/h5-11,20H,4,12H2,1-3H3